Results for:
Species: Pseudomonas aeruginosa

2-phenylacetaldehyde

Mass-Spectra

Compound Details

Synonymous names
phenylacetaldehyde
2-phenylacetaldehyde
122-78-1
Benzeneacetaldehyde
Hyacinthin
Phenylethanal
alpha-Tolualdehyde
2-Phenylethanal
Phenylacetic aldehyde
Oxophenylethane
alpha-Toluic aldehyde
Acetaldehyde, phenyl-
Benzylcarboxaldehyde
1-Oxo-2-phenylethane
Phenacetaldehyde
phenyl acetaldehyde
phenyl-Acetaldehyde
.alpha.-Tolualdehyde
Benzacetaldehyde
Phenylacetaldehyde (natural)
alpha-Phenylacetaldehyde
Benzenacetaldehyde
.alpha.-Toluic aldehyde
FEMA No. 2974
UNII-U8J5PLW9MR
NSC 406309
U8J5PLW9MR
EINECS 204-574-5
alpha-Tolyaldehyde
Acetaldehyde, phenyl- (8CI)
DTXSID3021483
CHEBI:16424
AI3-02175
NSC-406309
a-Tolyaldehyde
DTXCID501483
FEMA NO. 2874
CAS-122-78-1
benzeneethanal
a-Tolualdehyde
2-phenylethanone
a-toluic aldehyde
Phenylacetoaldehyde
benzene acetaldehyde
a-Phenylacetaldehyde
2-phenyl-acetaldehyde
bmse000427
NCIOpen2_003602
Phenylacetaldehyde, >=90%
SCHEMBL18972
PHENYLACETALDEHYDE [MI]
PHENYLACETALDEHYDE [FCC]
CHEMBL1233464
PHENYLACETALDEHYDE [FHFI]
STR00412
Tox21_201582
Tox21_302945
MFCD00006993
NSC406309
s9357
AKOS000119316
CCG-266073
CS-W011205
DB02178
HY-W010489
MCULE-3725701027
Phenylacetaldehyde, >=95%, FCC, FG
NCGC00249076-01
NCGC00256522-01
NCGC00259131-01
DB-041686
NS00013128
P0119
EN300-18996
C00601
D78329
10.14272/DTUQWGWMVIHBKE-UHFFFAOYSA-N.1
A804962
Q424998
doi:10.14272/DTUQWGWMVIHBKE-UHFFFAOYSA-N.1
Q-201558
F2190-0653
Z104472146
D60A2590-0A65-4BA8-A05B-D8423408535C
InChI=1/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H
Microorganism:

Yes

IUPAC name2-phenylacetaldehyde
SMILESC1=CC=C(C=C1)CC=O
InchiInChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2
FormulaC8H8O
PubChem ID998
Molweight120.15
LogP1.8
Atoms9
Bonds2
H-bond Acceptor1
H-bond Donor0
Chemical Classificationbenzenoids aldehydes aromatic compounds
CHEBI-ID16424
Supernatural-IDSN0075259

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANAKunze et al. 2013
ProkaryotaPseudomonas AeruginosaNANAKunze et al. 2013
EukaryotaCandida ParapsilosisNANAFitzgerald et al. 2022
EukaryotaAspergillus NigerNANACosta et al. 2016
EukaryotaCandida AlbicansNANACosta et al. 2016
EukaryotaPenicillium ChrysogenumNANACosta et al. 2016
ProkaryotaStaphylococcus AureusNAKarami et al. 2017
ProkaryotaAcinetobacter RadioresistensNATimm et al. 2018
ProkaryotaStaphylococcus EpidermidisNATimm et al. 2018
ProkaryotaPseudomonas Sp.antifungal activity against Thielaviopsis ethacetica mycelial growthBrazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; BrazilFreitas et al. 2022
EukaryotaCandida AlbicansATCC MYA-2876, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida GlabrataATCC 90030, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida TropicalisATCC 750, American Type Culture CollectionCosta et al. 2020
EukaryotaTuber Magnatumcollected from natural truffle orchards in Istria (Croatia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Baranya (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Somogy (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Abruzzo (Italy) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Kalubara (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Srem (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
ProkaryotaStaphylococcus EpidermidisAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaBacillus Cereuspromote fungal hypocrellin A production in Shiraia sp. S9isolate and deposite at the China General Microbiological Culture Collection Center (CGMCC)Xu et al. 2022
EukaryotaBotrytis Sp.NAKikuchi et al. 1983
EukaryotaFusarium Sp.NATakeuchi et al. 2012
EukaryotaAspergillus Sp.NASeifert and King 1982
EukaryotaGanoderma ApplanatumNAZiegenbein et al. 2010
ProkaryotaBacillus SimplexReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaBacillus SubtilisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaBacillus WeihenstephanensisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaMicrobacterium OxydansReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaStenotrophomonas MaltophiliaReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaStreptomyces LateritiusReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaSerratia MarcescensReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaStaphylococcus Xylosusn/aNASchulz and Dickschat 2007
ProkaryotaLactococcus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaArthrobacter Globiformisn/aNASchulz and Dickschat 2007
ProkaryotaBacillus Sp.Inhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
ProkaryotaStenotrophomonas MaltophiliaInhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
ProkaryotaAlcaligenes FaecalisInhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
ProkaryotaArthrobacter NitroguajacolicusInhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
ProkaryotaLysobacter GummosusInhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
ProkaryotaSporosarcina GinsengisoliInhibition of Mycelium growth of Paecilomyces lilacinus and Pochonia chlamydosporia.NAZou et al. 2007
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
ProkaryotaBurkholderia Graminisn/aNABlom et al. 2011
EukaryotaGanoderma Lucidumnasaprophytic on deciduous treesCampos Ziegenbein et al. 2006
EukaryotaSpongiporus Leucomallellusnasaprophytic mostly on wet, old pinesCampos Ziegenbein et al. 2006
EukaryotaFomitopsis PinicolanaGermanyRösecke et al. 2000
EukaryotaTrametes Suaveolensnanear Zachersmühle, Göppingen, southern GermanyRösecke et al. 2000
EukaryotaPleurotus EryngiinanaUsami et al. 2014
EukaryotaTuber MelanosporumNoneT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b
EukaryotaTuber IndicumNoneT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
ProkaryotaEnterobacter Sp.NANAAlmeida et al. 2022
Meyerozyma GuilliermondiiXiong et al. 2023
Enterobacter AgglomeransTallon et al. 2023
Enterobacter CloacaeTallon et al. 2023
Klebsiella OxytocaTallon et al. 2023
Saccharomyces CerevisiaePeng et al. 2023
Staphylococcus AureusWang et al. 2023
Pediococcus AcidilacticiMockus et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBMCC-IMSno
ProkaryotaPseudomonas AeruginosaLBMCC-IMSno
EukaryotaCandida ParapsilosisTSBSPME/GC-MSno
EukaryotaAspergillus NigerYeast Glucose ChloramphenicolSPME/GCxGC-MSno
EukaryotaCandida AlbicansYeast Glucose ChloramphenicolSPME/GCxGC-MSno
EukaryotaPenicillium ChrysogenumYeast Glucose ChloramphenicolSPME/GCxGC-MSno
ProkaryotaStaphylococcus AureusMueller Hinton broth (MB), tryptic soy broth (TSB)SPME, DVB/CAR/PDMS, GC-MSno
ProkaryotaAcinetobacter RadioresistensTSASPME, GC-MSno
ProkaryotaStaphylococcus EpidermidisMOPS glucose+EZSPME, GC-MSno
ProkaryotaPseudomonas Sp.LB mediaHS-SPME/GC-MSno
EukaryotaCandida AlbicansYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida GlabrataYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida TropicalisYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaTuber MagnatumGC-MS-Ono
ProkaryotaStaphylococcus EpidermidisBHI media, LB media, MHB media, TSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaBacillus CereusLB agarHS-SPME/GC-MSyes
EukaryotaBotrytis Sp.no
EukaryotaFusarium Sp.no
EukaryotaAspergillus Sp.no
EukaryotaGanoderma Applanatumno
ProkaryotaBacillus Simplexn/an/ano
ProkaryotaBacillus Subtilisn/an/ano
ProkaryotaBacillus Weihenstephanensisn/an/ano
ProkaryotaMicrobacterium Oxydansn/an/ano
ProkaryotaStenotrophomonas Maltophilian/an/ano
ProkaryotaStreptomyces Lateritiusn/an/ano
ProkaryotaSerratia Marcescensn/an/ano
ProkaryotaStaphylococcus Xylosusn/an/ano
ProkaryotaLactococcus Sp.n/an/ano
ProkaryotaArthrobacter Globiformisn/an/ano
ProkaryotaBacillus Sp.n/an/ano
ProkaryotaAlcaligenes Faecalisn/an/ano
ProkaryotaArthrobacter Nitroguajacolicusn/an/ano
ProkaryotaLysobacter Gummosusn/an/ano
ProkaryotaSporosarcina Ginsengisolin/an/ano
EukaryotaTuber Aestivumn/an/ano
EukaryotaTuber Melanosporumn/an/ano
ProkaryotaBurkholderia GraminisMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
EukaryotaGanoderma LucidumnaGC/MSno
EukaryotaSpongiporus LeucomallellusnaGC/MSno
EukaryotaFomitopsis PinicolanaGC/MSno
EukaryotaTrametes SuaveolensnaGC/MSno
EukaryotaPleurotus EryngiinaGC/MS, GC-O, AEDAno
EukaryotaTuber MelanosporumNoneNoneyes
EukaryotaTuber IndicumNoneNoneyes
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno
ProkaryotaEnterobacter Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
Meyerozyma GuilliermondiiYEPD, 10 g/L yeast extrac, 20 g/L peptone, 20 g dextroseGC-MS and GC-IMSno
Enterobacter Agglomeranstryptone soya broth (TSB) mediaTenax/GC/MSno
Enterobacter Cloacaetryptone soya broth (TSB) mediaTenax/GC/MSno
Klebsiella Oxytocatryptone soya broth (TSB) mediaTenax/GC/MSno
Saccharomyces Cerevisiaesea buckthorn juiceHS-SPME-GC–MS/UHPLC–MSno
Staphylococcus Aureusraw Shiyang chickenHS-GC-IMS/HS-SPME-GC-MSno
Pediococcus Acidilacticilentils (Lens culinaris)SPME/ICP-MSno


4-methylphenol

Compound Details

Synonymous names
4-methylphenol
P-CRESOL
106-44-5
4-Cresol
4-Hydroxytoluene
p-Methylphenol
para-Cresol
Phenol, 4-methyl-
p-Hydroxytoluene
p-Tolyl alcohol
p-Kresol
p-Oxytoluene
p-Toluol
p-Cresylic acid
1-Hydroxy-4-methylbenzene
Paracresol
p-Methylhydroxybenzene
1-Methyl-4-hydroxybenzene
Paramethyl phenol
para-Cresylic acid
4-methyl phenol
Cresol, para-
Cresol, p-
p-Kresol [German]
Cresol, p-isomer
FEMA No. 2337
CRESOL, PARA
p-Methyl phenol
4-methyl-phenol
4-methylphenol (p-cresol)
NSC 3696
MFCD00002376
1MXY2UM8NV
CHEMBL16645
DTXSID7021869
CHEBI:17847
NSC-3696
NCGC00091519-04
TOLUENE,4-HYDROXY (PARA-CRESOL)
p-Cresol [UN2076] [Poison, Corrosive]
DSSTox_CID_1869
DTXCID101869
CAS-106-44-5
CCRIS 647
HSDB 1814
EINECS 203-398-6
UNII-1MXY2UM8NV
para cresol
p-Cresylate
p-methyl-phenol
AI3-00150
?p-Cresol
Cresol,p-
Phenol, 4-methyI
p-Cresol, 99%
Spectrum_000850
p-Cresol, High Purity
P-CRESOL [FHFI]
P-CRESOL [HSDB]
P-CRESOL [INCI]
Spectrum2_000765
Spectrum4_001740
Spectrum5_000540
P-CRESOL [MI]
SCHEMBL375
bmse000458
EC 203-398-6
DSSTox_RID_77380
DSSTox_RID_77554
NCIOpen2_001516
WLN: QR D1
DSSTox_GSID_24364
DSSTox_GSID_24858
KBioGR_002160
KBioSS_001330
p-Cresol, analytical standard
BIDD:ER0010
DivK1c_000381
SPECTRUM1500209
p-Cresol, >=99%, FG
SPBio_000810
SCHEMBL7812506
SGCUT00097
HMS501D03
KBio1_000381
KBio2_001330
KBio2_003898
KBio2_006466
DTXSID30236875
DTXSID40185628
NSC3696
PARACRESOL [USP IMPURITY]
NINDS_000381
HMS1920A16
HMS2091I04
Pharmakon1600-01500209
p-Cresol, for synthesis, 98.0%
4-Methylphenol, analytical standard
NSC95259
to_000033
Tox21_113240
Tox21_113445
Tox21_200402
Tox21_201115
Tox21_300029
BDBM50008543
CCG-38990
NSC-95259
NSC756709
STL183323
AKOS000119005
Tox21_113445_1
DB01688
MCULE-2287247927
IDI1_000381
NCGC00013272-01
NCGC00091519-01
NCGC00091519-02
NCGC00091519-03
NCGC00091519-05
NCGC00091519-06
NCGC00091519-07
NCGC00091519-09
NCGC00253980-01
NCGC00257956-01
NCGC00258667-01
4-Methylphenol 10 microg/mL in Methanol
PS-11958
CAS-1319-77-3
p-Cresol, JIS special grade, >=99.0%
SBI-0051322.P003
METACRESOL IMPURITY C [EP IMPURITY]
NS00008242
4-Methylphenol 100 microg/mL in Cyclohexane
EN300-19427
p-Cresol, puriss. p.a., >=99.0% (GC)
AMYLMETACRESOL IMPURITY D [EP IMPURITY]
C01468
AB00051955_02
Q312251
SR-05000002037
J-001591
J-515803
SR-05000002037-1
F1908-0066
Z104473818
InChI=1/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H
2876-02-0
Microorganism:

Yes

IUPAC name4-methylphenol
SMILESCC1=CC=C(C=C1)O
InchiInChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3
FormulaC7H8O
PubChem ID2879
Molweight108.14
LogP1.9
Atoms8
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationbenzenoids aromatic compounds phenols alkylphenols
CHEBI-ID17847
Supernatural-IDSN0156844

mVOC Specific Details

Boiling Point
DegreeReference
201.9 °C peer reviewed
Volatilization
The Henry's Law constant for p-cresol is 1.0X10-6 atm-cu m/mole(1). This Henry's Law constant indicates that p-cresol is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as approximately 38 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as approximately 281 days(SRC). p-Cresol's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). p-Cresol may volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.11 mm Hg at 25 °C(3).
Soil Adsorption
A Koc of 49 was measured for o-cresol in a Brookston clay loam soil using OECD Guideline 106(1). Based on measured Freundlich isotherms for p-cresol in five different horizon soils (organic content of 0.3 to 0.9%)(2), the Koc ranged from 27 to 251 with an average of 173(SRC). Other reported Koc values include a Koc of 500 in soil and 645 in a sediment(3). According to a classification scheme(4), these Koc values indicate that p-cresol is expected to have very high to moderate mobility in soil.
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANAZhu et al. 2010
ProkaryotaStaphylococcus AureusNANAZhu et al. 2010
ProkaryotaEscherichia ColiNANADevaraj et al. 2018
ProkaryotaShigella SonneiChina Center of Industrial Culture collectionWang et al. 2018
ProkaryotaClostridium Difficileoutbreak 2006 UKRees et al. 2016
EukaryotaPhoma Sp.nanaNaznin et al. 2014
EukaryotaTuber Aestivumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
EukaryotaTuber Melanosporumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
ProkaryotaClostridium Difficilenastool specimens, from patients infected with clostridium difficileKuppusami et al. 2015
ProkaryotaPaenibacillus Polymyxacollection TU GrazRybakova et al. 2017
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaTSBSESI-MSno
ProkaryotaStaphylococcus AureusTSBSESI-MSno
ProkaryotaEscherichia ColiTSATD/GC-MSno
ProkaryotaShigella SonneiSodium chloride brothSPME, GC-MSno
ProkaryotaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
EukaryotaPhoma Sp.naSPME-GC/MSno
EukaryotaTuber Aestivumn/aGas chromatography-olfactometry (GC-O)no
EukaryotaTuber Melanosporumn/aGas chromatography-olfactometry (GC-O)no
ProkaryotaClostridium Difficilebrain heart infusion agar with 7% horse bloodPTR-ToF-MSno
ProkaryotaPaenibacillus PolymyxaGC-MS / SPMEno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno


1H-indole

Mass-Spectra

Compound Details

Synonymous names
indole
1H-Indole
120-72-9
2,3-Benzopyrrole
Indol
1-Benzazole
Ketole
1-Azaindene
Benzopyrrole
2,3-Benzopyrole
Indole (natural)
Caswell No. 498B
1-Benzo(b)pyrrole
Indol [German]
FEMA No. 2593
CCRIS 4421
HSDB 599
EPA Pesticide Chemical Code 025000
1H-Benzo[b]pyrrole
Benzo[b]pyrrole
AI3-01540
NSC 1964
EINECS 204-420-7
MFCD00005607
UNII-8724FJW4M5
INDOLUM
DTXSID0020737
CHEBI:16881
8724FJW4M5
NSC-1964
CHEMBL15844
DTXCID40737
Indole 100 microg/mL in Acetonitrile
NCGC00167539-01
INDOLE (USP-RS)
INDOLE [USP-RS]
IND
CAS-120-72-9
benzazole
mono-indole
1-H-indole
Indole, 7
Indole (8CI)
Indole (white flake)
Indole, 98%
1H-Indole (9CI)
INDOLUM [HPUS]
INDOLE [FHFI]
INDOLE [HSDB]
INDOLE [FCC]
INDOLE [MI]
Indole, >=99%
SCHEMBL698
bmse000097
Indole, analytical standard
Indole, >=99%, FG
WLN: T56 BMJ
BIDD:GT0304
SCHEMBL940818
INDOLE BENZO-PYRROLE
SCHEMBL1921769
SCHEMBL9559244
AMY3411
NSC1964
185l
BCP27232
STR01201
Tox21_112536
Tox21_201677
Tox21_302937
BBL011739
BDBM50094702
s6358
STL163380
Indole, 3-Benzopyrrole, 1-benzazole
AKOS000119629
Tox21_112536_1
AT36838
CG-0501
CS-W001132
DB04532
HY-W001132
Indole, puriss., >=98.5% (GC)
MCULE-9442796928
NCGC00167539-02
NCGC00167539-03
NCGC00256348-01
NCGC00259226-01
BP-10563
DS-011308
I0021
NS00010849
EN300-18285
C00463
I-0800
I-0810
Q319541
SR-01000944736
SR-01000944736-1
Z57833933
F2190-0647
InChI=1/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9
82451-55-6
Microorganism:

Yes

IUPAC name1H-indole
SMILESC1=CC=C2C(=C1)C=CN2
InchiInChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H
FormulaC8H7N
PubChem ID798
Molweight117.15
LogP2.1
Atoms9
Bonds0
H-bond Acceptor0
H-bond Donor1
Chemical Classificationaromatic compounds heterocyclic compounds nitrogen compounds
CHEBI-ID16881
Supernatural-IDSN0346338

mVOC Specific Details

Boiling Point
DegreeReference
254 °CPhysProp
253 deg C @ 762 mm Hg; 128-133 deg C @ 28 mm HgBudavari, S. (ed.). The Merck Index - An Encyclopedia of Chemicals, Drugs, and Biologicals. Whitehouse Station, NJ: Merck and Co., Inc., 1996., p. 851
Volatilization
The Henry's Law constant for indole is estimated as 5.3X10-7 atm-cu m/mole(SRC) from its experimental values for vapor pressure, 0.0122 mm Hg(1), and water solubility, 3560 mg/l(2). This value indicates that indole will be essentially nonvolatile from water surfaces(3,SRC). Indole's Henry's Law constant(1,2,SRC) indicates that volatilization from moist soil surfaces should not occur(SRC).
Literature: (1) Yaws CL; Handbook of Vapor Pressure. Volume 3. C8 to C28 Compounds. HOuston,TX: Gulf Publ Co (1994) (2) Yalkowsky SH, Dannenfelser RM; Aquasol Database of Aqueous Solubility. Ver 5. College of Pharmacy, University of Arizona - Tucson, AZ. PC Ver (1992) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
A Koc of 187 was measured for indole on a synthetic soil consisting of 88-90% sand, 10% clay and 0-2% humic acid(1). The Koc of indole is estimated as approximately 350(SRC), using a measured log Kow of 2.14(2) and a regression-derived equation(3,SRC). According to a recommended classification scheme(4), these Koc values suggest that indole has moderate mobility in soil(SRC).
Literature: (1) Rebhun M et al; Water Res 26: 79-84 (1992) (2) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Amer Chem Soc, Washington, DC. p. 6 (1995) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (4) Swann RL et al; Res Rev 85: 23 (1983)
Vapor Pressure
PressureReference
0.0122 mm Hg at 25 deg CYaws CL; Handbook of Vapor Pressure. Volume 3. C8 to C28 Compounds. Gulf Publishing Co.: Houston, TX (1994)
MS-Links
MS-MS Spectrum 225355
MS-MS Spectrum 225356
MS-MS Spectrum 183055
MS-MS Spectrum 225360
MS-MS Spectrum 182706
MS-MS Spectrum 225361
MS-MS Spectrum 225351
MS-MS Spectrum 183056
MS-MS Spectrum 225354
MS-MS Spectrum 182708
MS-MS Spectrum 225353
MS-MS Spectrum 182707
MS-MS Spectrum 1047 - Quattro_QQQ 10V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 4590 - EI-B (MX-1303) Positive
MS-MS Spectrum 1049 - Quattro_QQQ 40V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 225352
MS-MS Spectrum 225359
MS-MS Spectrum 225358
MS-MS Spectrum 225362
MS-MS Spectrum 1048 - Quattro_QQQ 25V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 4592 - EI-B (HITACHI M-68) Positive
MS-MS Spectrum 225357
MS-MS Spectrum 4593 - LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) Positive
MS-MS Spectrum 4591 - EI-B (Unknown) Positive
MS-MS Spectrum 183054
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANADolch et al. 2012
ProkaryotaPseudomonas AeruginosaNANADolch et al. 2012
ProkaryotaEscherichia ColiNANAKunze et al. 2013
ProkaryotaEscherichia ColiNANAZhu et al. 2010
ProkaryotaPseudomonas AeruginosaNANAZhu et al. 2010
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAScotter et al. 2006
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAThorn et al. 2011
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAAhmed et al. 2023
ProkaryotaEscherichia ColiNANAFitzgerald et al. 2021
ProkaryotaEscherichia ColiNANAHewett et al. 2020
ProkaryotaEscherichia ColiNANADevaraj et al. 2018
ProkaryotaEscherichia ColiNANABoots et al. 2014
ProkaryotaEscherichia ColiNANALawal et al. 2018a
ProkaryotaEscherichia ColiNANADixon et al. 2022
ProkaryotaEscherichia ColiNANAJünger et al. 2012
ProkaryotaEscherichia ColiChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
ProkaryotaShigella FlexneriChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
EukaryotaCandida AlbicansNAKarami et al. 2017
ProkaryotaEscherichia ColiNAKarami et al. 2017
EukaryotaHypoxylon InvadensNADickschat et al. 2018
ProkaryotaShigella SonneiChina Center of Industrial Culture collectionWang et al. 2018
ProkaryotaVibrio ParahaemolyticusChina Center of Industrial Culture collectionWang et al. 2018
ProkaryotaHyphomonas Sp.swine wastewaterCho et al. 2019
ProkaryotaSphingomonas Sp.swine wastewaterCho et al. 2019
ProkaryotaProteus Vulgarisrhizosphere of lahophyte plant, Glasswort (Salicornia herbacea L.)Yu et al. 2013
ProkaryotaEscherichia ColiLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaEscherichia ColiSwedish Institute for Communicable Disease Control (SMI), Stockholm, SwedenSousa et al. 2023
ProkaryotaLoktanella Sp.It is able to regulate biofilm formation. It also induces the formation of myxospores in Stigmatella aurantiaca.NASchulz and Dickschat 2007
ProkaryotaEnterobacter Sp.It is able to regulate biofilm formation. It also induces the formation of myxospores in Stigmatella aurantiaca.NASchulz and Dickschat 2007
ProkaryotaKlebsiella Sp.It is able to regulate biofilm formation. It also induces the formation of myxospores in Stigmatella aurantiaca.NASchulz and Dickschat 2007
ProkaryotaEscherichia ColiIt is able to regulate biofilm formation. It also induces the formation of myxospores in Stigmatella aurantiaca.NASchulz and Dickschat 2007
ProkaryotaEscherichia ColiRegulation of expression of multi-drug exporter genes and inhibition of biofilm formation of Escherichia coli, Pseudomonas fluorescens and Pseudomonas aeruginosa.NARyan and Dow 2008
ProkaryotaShigella Flexnerin/aNABunge et al. 2008
ProkaryotaSerratia Odoriferan/aNAWeise et al. 2014
ProkaryotaBurkholderia Andropogonisn/aNABlom et al. 2011
ProkaryotaBurkholderia Anthinan/aNABlom et al. 2011
ProkaryotaBurkholderia Caledonican/aNABlom et al. 2011
ProkaryotaBurkholderia Caribensisn/aNABlom et al. 2011
ProkaryotaBurkholderia Fungorumn/aNABlom et al. 2011
ProkaryotaBurkholderia Gladiolin/aNABlom et al. 2011
ProkaryotaBurkholderia Glathein/aNABlom et al. 2011
ProkaryotaBurkholderia Glumaen/aNABlom et al. 2011
ProkaryotaBurkholderia Graminisn/aNABlom et al. 2011
ProkaryotaBurkholderia Latan/aNABlom et al. 2011
ProkaryotaBurkholderia Pyrrocinian/aNABlom et al. 2011
ProkaryotaCellulomonas Udan/aNABlom et al. 2011
ProkaryotaChromobacterium Violaceumn/aNABlom et al. 2011
ProkaryotaEscherichia Colin/aNABlom et al. 2011
ProkaryotaPseudomonas Aeruginosan/aNABlom et al. 2011
ProkaryotaPseudomonas Chlororaphisn/aNABlom et al. 2011
ProkaryotaPseudomonas Putidan/aNABlom et al. 2011
ProkaryotaSerratia Proteamaculansn/aNABlom et al. 2011
ProkaryotaStenotrophomonas Rhizophilan/aNABlom et al. 2011
ProkaryotaKlebsiella Pneumoniaen/aNATait et al. 2014
ProkaryotaStaphylococcus Aureusn/aNATait et al. 2014
ProkaryotaAzospirillum Brasilensepromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
ProkaryotaBacillus Pumiluspromotion of performance of Chlorella sorokiniana ShihNAAmavizca et al. 2017
ProkaryotaEscherichia Colipromotion of performance of Chlorella sorokiniana ShihNAAmavizca et al. 2017
ProkaryotaEscherichia ColiAmerican Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
ProkaryotaHaemophilus InfluenzaeclinicPreti et al. 2009
EukaryotaPuccinia PunctiformisNAConnick and French 1991
EukaryotaAspergillus ClavatusNASeifert and King 1982
ProkaryotaChryseobacterium Sp.nanaTyc et al. 2015
EukaryotaPleurotus CystidiosusnanaUsami et al. 2014
EukaryotaMetschnikowia LopburiensisNANALjunggren et al. 2019
EukaryotaMetschnikowia PulcherrimaNANALjunggren et al. 2019
ProkaryotaBacillus SubtilisNANALee et al. 2023
Enterobacter CloacaeTallon et al. 2023
Klebsiella OxytocaTallon et al. 2023
Enterobacter AgglomeransTallon et al. 2023
Staphylococcus AureusWang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBIMR-MSno
ProkaryotaPseudomonas AeruginosaLBIMR-MSno
ProkaryotaEscherichia ColiLBMCC-IMSno
ProkaryotaEscherichia ColiTSBSESI-MSno
ProkaryotaPseudomonas AeruginosaTSBSESI-MSno
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia Colihuman bloodSIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaStaphylococcus AureusBacT/ALERT FASIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStreptococcus PneumoniaeBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiNBTD/GC-MSno
ProkaryotaEscherichia ColiLBSPME/GC-MSno
ProkaryotaEscherichia ColiBHISPME/GC-MSno
ProkaryotaEscherichia ColiTSBSPME/GC-MSno
ProkaryotaEscherichia ColiTSATD/GC-MSno
ProkaryotaEscherichia ColiMueller–HintonTD/GC-MSno
ProkaryotaEscherichia ColiASMTD/GC-MSno
ProkaryotaEscherichia ColiLBTD/GC-MSno
ProkaryotaEscherichia ColiColumbia sheep bloodTD/GC-MS and MCC-IMSno
ProkaryotaEscherichia ColiTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
ProkaryotaShigella FlexneriTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
EukaryotaCandida AlbicansMueller Hinton broth (MB), tryptic soy broth (TSB)SPME, DVB/CAR/PDMS, GC-MSno
ProkaryotaEscherichia ColiMueller Hinton broth (MB), tryptic soy broth (TSB)SPME, DVB/CAR/PDMS, GC-MSno
EukaryotaHypoxylon InvadensYMG mediumCSLA-GCMSno
ProkaryotaShigella SonneiSodium chloride brothSPME, GC-MSno
ProkaryotaVibrio ParahaemolyticusSodium chloride brothSPME, GC-MSno
ProkaryotaHyphomonas Sp.Luria-Bertani (LB)SPME, GC-MSno
ProkaryotaSphingomonas Sp.Luria-Bertani (LB)SPME, GC-MSno
ProkaryotaProteus VulgarisLB agarSPME, GC-MSyes
ProkaryotaEscherichia ColiTSB mediaHS-SPME/GC-MSno
ProkaryotaEscherichia ColiLB media, rocket lysate, spinach lysateHS-SPME/GC-MSno
ProkaryotaLoktanella Sp.n/an/ano
ProkaryotaEnterobacter Sp.n/an/ano
ProkaryotaKlebsiella Sp.n/an/ano
ProkaryotaEscherichia Colin/an/ano
ProkaryotaShigella Flexnerin/an/ano
ProkaryotaSerratia OdoriferaNBIIHeadspace trapping/ GC-MSno
ProkaryotaBurkholderia AndropogonisMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia AnthinaMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia CaledonicaMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia CaribensisMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia FungorumMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GladioliMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GlatheiMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GlumaeMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GraminisMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia LataLBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia PyrrociniaMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaCellulomonas UdaMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaChromobacterium ViolaceumMR-VP and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaEscherichia Coli LB, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPseudomonas AeruginosaLB, MR-VP and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPseudomonas ChlororaphisLB and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPseudomonas PutidaLB and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaSerratia ProteamaculansMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaStenotrophomonas RhizophilaMS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaKlebsiella PneumoniaeBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar and non-polar GC Columnno
ProkaryotaStaphylococcus AureusBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar and non-polar GC Columnno
ProkaryotaAzospirillum BrasilenseTSASPME-GCno
ProkaryotaBacillus PumilusTSASPME-GCno
ProkaryotaEscherichia ColiTSASPME-GCno
ProkaryotaEscherichia ColiTS brothGC-MS Super Qno
ProkaryotaHaemophilus InfluenzaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
EukaryotaPuccinia Punctiformisno
EukaryotaAspergillus Clavatusno
ProkaryotaChryseobacterium Sp.Tryptic soy broth agarGC/MS-Q-TOFno
EukaryotaPleurotus CystidiosusnaGC/MS, GC-O, AEDAno
EukaryotaMetschnikowia Lopburiensisliquid YPD mediumGC-MSno
EukaryotaMetschnikowia Pulcherrimaliquid YPD mediumGC-MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno
Enterobacter Cloacaetryptone soya broth (TSB) mediaSPME/GC/MSno
Klebsiella Oxytocatryptone soya broth (TSB) mediaSPME/GC/MSno
Enterobacter Agglomeranstryptone soya broth (TSB) mediaTenax/GC/MSno
Staphylococcus Aureusraw Shiyang chickenHS-GC-IMS/HS-SPME-GC-MSno


Pyridine

Mass-Spectra

Compound Details

Synonymous names
PYRIDINE
Azabenzene
110-86-1
Azine
Pyridin
Piridina
Pirydyna
Pyridin [German]
Pirydyna [Polish]
Piridina [Italian]
RCRA waste number U196
Caswell No. 717
NCI-C55301
FEMA No. 2966
FEMA Number 2966
CCRIS 2926
HSDB 118
CHEBI:16227
CP 32
EINECS 203-809-9
NSC 406123
pyridine-ring
pyridine-
UNII-NH9L3PP67S
NH9L3PP67S
EPA Pesticide Chemical Code 069202
DTXSID9021924
AI3-01240
NSC-141574
NSC-406123
PYRIDINE (15N)
DTXCID101924
EC 203-809-9
MFCD00011732
PYRIDINE (IARC)
PYRIDINE [IARC]
Pyridine [UN1282] [Flammable liquid]
PYRIDINE (USP-RS)
PYRIDINE [USP-RS]
Pyridine, ACS reagent, >=99.0%
Pyridine, ReagentPlus(R), >=99%
UN1282
CEFTAZIDIME IMPURITY F (EP IMPURITY)
CEFTAZIDIME IMPURITY F [EP IMPURITY]
RCRA waste no. U196
CEFTAZIDIME PENTAHYDRATE IMPURITY F (EP IMPURITY)
CEFTAZIDIME PENTAHYDRATE IMPURITY F [EP IMPURITY]
hydropyridine
N-pyridine
pyridine fraction
3-pyridinyl
[pyridine]
2-pyridine
4-pyridine
Pyridine II
Pyridine III
3-Pyridine
Pyridine anhydrous
Azabenzene; Azine
0PY
Pyridine, anhydrous
Pyridine, 99%
Pyridine, ACS reagent
Pyridine, >=99%
Pyridine, HPLC Grade
PYRIDINE [FHFI]
PYRIDINE [HSDB]
PYRIDINE [MI]
bmse000432
Epitope ID:140099
WLN: T6NJ
Pyridine, p.a., 99%
NCIOpen2_002809
NCIOpen2_007786
NCIOpen2_007866
NCIOpen2_007986
NCIOpen2_007999
Pesticide Code: 069202
Pyridine, LR, >=99%
Pyridine, analytical standard
Pyridine, anhydrous, 99.8%
CHEMBL266158
Pyridine, AR, >=99.5%
Pyridine, >=99.5% (GC)
DTXSID101318102
BCP23599
Pyridine, for HPLC, >=99.9%
Tox21_200960
BDBM50176909
NSC141574
NSC406123
Pyridine, anhydrous Water 30ppm Max
STL264195
AKOS000120998
MCULE-4028120692
Pyridine, biotech. grade, >=99.9%
UN 1282
NCGC00091476-01
NCGC00091476-02
NCGC00258513-01
Pyridine, SAJ first grade, >=99.0%
BP-13452
CAS-110-86-1
NCI60_006101
Pyridine, JIS special grade, >=99.5%
Pyridine, p.a., ACS reagent, 99.0%
Pyridine, purification grade, >=99.75%
DB-220141
Pyridine, spectrophotometric grade, >=99%
NS00010113
Q0034
EN300-17264
C00747
A802257
Q210385
J-002482
InChI=1/C5H5N/c1-2-4-6-5-3-1/h1-5
F0001-0227
Pyridine, puriss. p.a., ACS reagent, >=99.8% (GC)
Pyridine, suitable for hydroxyl value determination, >=99.5%
Pyridine; Azabenzene; Azine; CP 32; NSC 141574; NSC 406123
Pyridine, Pharmaceutical Secondary Standard; Certified Reference Material
Pyridine, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99.5% (GC)
0.25 M Hyacinth BMT solution BMT in anhydrous Acetonitrile, NC-0102 emp Biotech GmbH
Pyridine, puriss., absolute, over molecular sieve (H2O <=0.005%), >=99.8% (GC)
Pyridine, puriss., Reag. Ph. Eur., dried, >=99.5% (GC), <=0.0075% water
Solvent Mix Pyridine in ACN (V / V = 60 : 40) NC-0612, GL45 thread emp Biotech GmbH
29761-81-7
Pyridine for oligo synthesis (Water content < 30 ppm) NC-0604 2.5 L GL45 thread emp Biotech GmbH
Microorganism:

Yes

IUPAC namepyridine
SMILESC1=CC=NC=C1
InchiInChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H
FormulaC5H5N
PubChem ID1049
Molweight79.1
LogP0.7
Atoms6
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationaromatic compounds heterocyclic compounds pyridines nitrogen compounds
CHEBI-ID16227
Supernatural-IDSN0175542

mVOC Specific Details

Boiling Point
DegreeReference
115.2 °C peer reviewed
Volatilization
The Henry's Law constant for pyridine is 1.1X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that pyridine is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3 days(SRC). The volatilization half- life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 25 days(SRC). Pyridine's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). Pyridine is a weak base with a pKa of 5.23(3), which indicates this compound will partially exist in the protonated form in acidic conditions, and no volatilization from water or moist soil will occur for the cation(SRC). The potential for volatilization of pyridine from dry soil surfaces may exist(SRC) based upon a vapor pressure of 20.8 mm Hg(4).
Literature: (1) Hawthorne SB et al; Environ Sci Technol 19: 922-927 (1985) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Bintein S, Devillers J; Chemosphere 28: 1171-88 (1994) (4) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation Washington, DC: Taylor and Francis (1989)
Soil Adsorption
The Koc of pyridine is estimated as 50(SRC), using a measured log Kow of 0.65(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that pyridine is expected to have high mobility in soil. The pKa of pyridine is 5.23(4), which indicates that pyridine will partially exist in the protonated form under acidic conditions and cations adsorb more strongly to soil surfaces than neutral molecules(SRC). The adsorption of pyridine to a basic subsoil (pH 8.15, 0.58% organic carbon) is negligible, while in an acidic subsoil (pH 4.85, O.24% organic carbon), the Freundlich adsorption constant was measured to be 5.78 and the slope 0.679(5). This suggests a cationic adsorption mechanism as pyridine is predominantly in its protonated form. Pyridine adsorbs to colloidal particles of sodium montmorillonite and kaolinite, a process which is attributed to cation exchange and is a function of pH(5). Adsorption is at a minimum at pH 1 and 11 and reaches a maximum at pH 4 for the montmorillonite and pH 5.5 for the kaolinite where the adsorption constants are 60 and 10, respectively(6).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 12 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Bintein S, Devillers J; Chemosphere 28: 1171-88 (1994) (5) Felice LJ et al; Quinoline Partitioning In Substance Materials Adsorption, Desorption, and Solute Competition PNL-SA-11728 Battelle Pacific NW Labs pp. 19 (1984) (6) Baker RA, Lu MD; Water Res 5: 839-48 (1971)
Vapor Pressure
PressureReference
20.8 mm Hg @ 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
MS-MS Spectrum 4884 - EI-B (HITACHI M-80B) Positive
MS-MS Spectrum 4883 - EI-B (HITACHI RMU-7M) Positive
MS-MS Spectrum 4887 - LC-ESI-QQ (API3000, Applied Biosystems) 30V Positive
MS-MS Spectrum 225461
MS-MS Spectrum 4888 - LC-ESI-QQ (API3000, Applied Biosystems) 40V Positive
MS-MS Spectrum 1315 - Quattro_QQQ 10V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 4889 - LC-ESI-QQ (API3000, Applied Biosystems) 50V Positive
MS-MS Spectrum 225459
MS-MS Spectrum 225452
MS-MS Spectrum 4882 - EI-B (Unknown) Positive
MS-MS Spectrum 225462
MS-MS Spectrum 225454
MS-MS Spectrum 225463
MS-MS Spectrum 4885 - LC-ESI-QQ (API3000, Applied Biosystems) 10V Positive
MS-MS Spectrum 225456
MS-MS Spectrum 225457
MS-MS Spectrum 1316 - Quattro_QQQ 25V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 4886 - LC-ESI-QQ (API3000, Applied Biosystems) 20V Positive
MS-MS Spectrum 225455
MS-MS Spectrum 4881 - EI-B (MX-1303) Positive
MS-MS Spectrum 1317 - Quattro_QQQ 40V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 225453
MS-MS Spectrum 225451
MS-MS Spectrum 225458
MS-MS Spectrum 225460
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
EukaryotaTausonia Pullulansinhibitory and promoting effects on the growth of different microorganismsisolate from Silene acaulis, Ny-Ålesund (Svalbard Archipelago, Arctic); CCTCC (China Center for Type Culture Collection, Wuhan, Hubei, China)Niu et al. 2022
EukaryotaFusarium Sp.NABrock et al. 2011
EukaryotaPleurotus EryngiinanaUsami et al. 2014
EukaryotaTuber MelanosporumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b
Lentinula EdodesGeng et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
EukaryotaTausonia Pullulansartificial nectar mediaGC-MSno
EukaryotaFusarium Sp.no
EukaryotaPleurotus EryngiinaGC/MS, GC-O, AEDAno
EukaryotaTuber Melanosporumyes
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno


Compound Details

Synonymous names
phenol
108-95-2
carbolic acid
Hydroxybenzene
Phenic acid
Oxybenzene
Benzenol
Phenylic acid
Phenylic alcohol
Monophenol
Phenyl hydrate
Phenyl hydroxide
PhOH
Monohydroxybenzene
Paoscle
Phenole
Izal
Phenyl alcohol
Phenol alcohol
Acide carbolique
Phenol, liquefied
Fenolo
Carbolsaure
Phenosmolin
Fenol
Liquid phenol
Phenol, pure
Benzene, hydroxy-
Rcra waste number U188
Liquefied phenol
Liquified Phenol
Carbolicum acidum
Fenolo [Italian]
NCI-C50124
Phenole [German]
Campho-Phenique Gel
phenylalcohol
UN 2312 (molten)
Phenol [JAN]
UN 1671 (solid)
Phenic
Carbolsaure [German]
Caswell No. 649
Campho-Phenique Liquid
Phenol, molten
2-allphenol
Baker's P & S liquid & Ointment
Fenol [Dutch, Polish]
NSC 36808
Phenol, liquified
Baker's P and S Liquid and Ointment
Monohydroxy benzene
Acide carbolique [French]
CCRIS 504
Campho-Phenique Cold Sore Gel
Carbolsaeure
FEMA No. 3223
Karbolsaeure
HSDB 113
Phenoxy
acide phenique
DTXSID5021124
Phenic alcohol
Phenol,liquified
Synthetic phenol
Phenol, dimer
AI3-01814
RCRA waste no. U188
EINECS 203-632-7
UNII-339NCG44TV
MFCD00002143
NSC-36808
UN1671
UN2312
UN2821
EPA Pesticide Chemical Code 064001
339NCG44TV
CHEBI:15882
Phenol [USP:JAN]
ENT-1814
27073-41-2
CHEMBL14060
DTXCID501124
EC 203-632-7
NSC36808
Phenol, Glass Distilled Under Argon
65996-83-0
Phenol, solid [UN1671] [Poison]
Phenol (USP:JAN)
Phenol, molten [UN2312] [Poison]
NCGC00091454-04
Fenosmoline
Fenosmolin
PHENOL (IARC)
PHENOL [IARC]
PHENOL (USP-RS)
PHENOL [USP-RS]
PHENOL (II)
PHENOL [II]
PHENOL (MART.)
PHENOL [MART.]
Phenol, >=99.0%
17442-59-0
PHENOL (EP MONOGRAPH)
PHENOL [EP MONOGRAPH]
PHENOL (USP MONOGRAPH)
PHENOL [USP MONOGRAPH]
Phen-2,4,6-d3-ol-d
Carbol
hydroxy benzene
Phenol 100 microg/mL in Methanol
Phenol, liquid
Phenol, solid
Baker's p and s
Phenol, sulfurated
CAS-108-95-2
METACRESOL IMPURITY A (EP IMPURITY)
METACRESOL IMPURITY A [EP IMPURITY]
(14C)Phenol
HEXYLRESORCINOL IMPURITY A (EP IMPURITY)
HEXYLRESORCINOL IMPURITY A [EP IMPURITY]
PHENOL (2,3,4,5,6-D5)
arenols
Benzophenol
Karbolsaure
Phylorinol
Ulcerease
Hydroxy-benzene
Phenol liquid
Phenol molten
Fungus Fighte
Phenol synthetic
Pandy's reagent
Cepastat lozenges
Fortinia ID
Phenol, labeled with carbon-14
Acidum Carbolicum
Phenol (liquid)
2-phenyl alcohol
Sore ThroatCherry
Phenol, synthetic
Phenol, ultrapure
ABC Sore Throat
HEB Sore Throat
Phenol ACS grade
RugbyCherry Flavor
Sore ThroatMenthol
Sore Throat Spray
Meijer Sore Throat
Sore Throat Cherry
Sore Throat Relief
Liquefied phenol BP
Paoscle (TN)
Topcare Sore Throat
Carbolic acid liquid
Phenol (TN)
Phenol,(S)
TopCareCherry Flavor
Phenol, ACS reagent
PUBLIX Sore Throat
Carbolic acid, liquid
CepastatExtra Strength
Walgreens Sore Throat
63496-48-0
Sore ThroatReadyInCase
Vortex Moisturizer Oral
1ai7
1li2
4i7l
Liquefied phenol (TN)
DRx Choice Sore Throat
PHENOL [VANDF]
Wild Horse 777 Oral
PHENOL [FHFI]
PHENOL [HSDB]
PHENOL [INCI]
Sore Throat ReliefCherry
Castellani Paint 1.5%
Phenol (JP17/USP)
PHENOL [WHO-DD]
Phenol, detached crystals
Pain RelievingPetro Carbo
PHENOL [MI]
Phenol, >=99%
Sore Throat ReliefMenthol
WLN: QR
Good Neighbor Sore Throat
Liquefied phenol (JP17)
bmse000290
bmse010026
C6H5OH
Fenol(DUTCH, POLISH)
NICE SORE THROAT Cherry
PHENOL, 80% in ethanol
Phenol, LR, >=99%
HEB Sore ThroatCherry Flavor
MLS001065591
Phenol (CGA 73330)
Phenol, for molecular biology
BIDD:ER0293
Phenol for disinfection (TN)
ABC Sore ThroatMenthol Flavor
HEB Sore ThroatMenthol Flavor
NICE SORE THROAT Spearmint
Phenol, natural, 97%, FG
CHLORASEPTIC SORE THROAT
Chloraseptic Sore Throat Cherry
Chloraseptic Sore Throat Citrus
Cuticura pain relieving ointment
Sore Throat ReliefCherry Flavor
CARBOLICUM ACIDUM [HPUS]
DTXSID9075294
Phenol, AR, >=99.5%
PHENOL,LIQUIFIED [VANDF]
BDBM26187
CHEBI:33853
Phenol for disinfection (JP17)
Topcare Sore ThroatMenthol Flavor
3f39
Phenol 10 microg/mL in Methanol
PUBLIX Sore ThroatMenthol Flavor
Walgreens Sore ThroatCherry Flavor
phenol 0.6% anesthetic oral rinse
Tox21_113463
Tox21_201639
Tox21_300042
DRx Choice Sore ThroatMenthol Flavor
Phenol 5000 microg/mL in Methanol
STL194294
AKOS000119025
Eos Medicated Pain Relieving Lip Balm
Tox21_113463_1
DB03255
Good Neighbor Sore ThroatCherry Flavor
MCULE-9943948107
NA 2821
Phenol, BioXtra, >=99.5% (GC)
Phenol, SAJ first grade, >=98.0%
UN 1671
UN 2312
UN 2821
USEPA/OPP Pesticide Code: 064001
NCGC00091454-01
NCGC00091454-02
NCGC00091454-03
NCGC00091454-05
NCGC00091454-06
NCGC00091454-07
NCGC00254019-01
NCGC00259188-01
Phenol, JIS special grade, >=99.0%
61788-41-8
73607-76-8
AM802906
BP-30160
METHYL SALICYLATE IMPURITY B [EP]
SMR000568492
Phenol 1000 microg/mL in Dichloromethane
Phenol, PESTANAL(R), analytical standard
Liquified Phenol (contains 7-10 % water)
NS00010045
P1610
P2771
EN300-19432
C00146
D00033
Phenol, unstabilized, ReagentPlus(R), >=99%
SALICYLIC ACID IMPURITY C [EP IMPURITY]
Phenol, p.a., ACS reagent, 99.5-100.5%
PUBLIX Sore Throat Fast Relief Oral Anesthetic
Q130336
CVS Health Sore Throat Fast Relief Oral Anesthetic
J-610001
Phenol, for molecular biology, ~90% (T), liquid
A13-01814
F1908-0106
Phenol, unstabilized, purified by redistillation, >=99%
Z104473830
InChI=1/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7
Phenol, BioUltra, for molecular biology, >=99.5% (GC)
Phenol, United States Pharmacopeia (USP) Reference Standard
Liquified Phenol, meets USP testing specifications, >=89.0%
Phenol, BioUltra, for molecular biology, TE-saturated, ~73% (T)
phenol;phenol [jan];phenol, pure;phenol phenol [jan] phenol, pure
Phenol, puriss. p.a., ACS reagent, reag. Ph. Eur., 99.0-100.5%
Phenol, contains hypophosphorous as stabilizer, loose crystals, ACS reagent, >=99.0%
Phenol, puriss., meets analytical specification of Ph. Eur., BP, USP, 99.5-100.5% (GC)
Phenol, puriss., meets analytical specification of Ph. Eur., BP, USP, >=99.5% (GC), crystalline (detached)
Microorganism:

Yes

IUPAC namephenol
SMILESC1=CC=C(C=C1)O
InchiInChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
FormulaC6H6O
PubChem ID996
Molweight94.11
LogP1.5
Atoms7
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationaromatic compounds phenols benzenoids
CHEBI-ID15882
Supernatural-IDSN0154453

mVOC Specific Details

Boiling Point
DegreeReference
181.75 °C peer reviewed
Volatilization
The Henry's Law constant for phenol is 3.33X10-7 atm-cu m/mol at 25 deg C(1). This Henry's Law constant indicates that phenol is expected to be essentially nonvolatile from water surfaces(2). Phenols's Henry's Law constant indicates that volatilization from moist soil surfaces in not expected to occur(SRC). Phenol is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.35 mm Hg(3).
Literature: (1) Gaffney JS et al; Environ Sci Technol 21: 519-23 (1987))(2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Bingham E et al, eds; Patty's Toxicology. 5th ed. NY, NY: John Wiley & Sons Inc. 4: 383 (2001)
Soil Adsorption
Phenol is reported to have low adsorptivity to clay soils and silt loam(1) and no adsorption to aquifer material(3) and montmorillonite and kaolinite clays(8). The Koc for phenol to a Batcombe silt loam soil (pH 6.7, organic carbon 2.51%) was 30(6). It was 16 for a Brookstone clay loam (pH 5.7, organic matter 5.1%) and varied with pH and iron content of the soil(7). The Freundlich K and (1/N) for phenol in Captina (pH 5.7, 1.1 % organic matter) and Palouse silt loam (pH 5.7, 3.6% organic matter) soils were 0.58 (1.15) and 0.81 (1.00)(2); the Koc values for these soils are 91 and 39(SRC). Based on the reported Koc values, phenol would be expected to generally exhibit very high mobility in soil, based on a classification scheme(4). In a study of the adsorption of phenol onto siltstone associated with a Wyoming coal deposit suitable for in situ gasification, the pH of the solution was the major controlling factor with adsorption occurring at pH's below the pKa of phenol and no adsorption occurring at pH's above the pKa(5). The log of the Freundlich K value was approximately -4(5). Therefore, phenol may be transported by groundwater near in situ coal gasification sites due to the elevated pH's at these sites after gasification(5). The pKa of phenol is 9.99(9), indicating that it will be partially dissociated at the upper end of environmental pH range and its mobility may be pH dependent(SRC). In general, anions generally do not adsorb to organic carbon and clay as strongly as their neutral counterparts(10).
Literature: (1) Artiola-Fortuny J, Fuller WH; Soil Sci 133: 18-26 (1982) (2) Scott HD et al; J Environ Qual 12: 91-5 (1983) (3) Ehrlich GG et al; Groundwater 20: 703-10 (1982) (4) Swann RL et al; Res Rev 85: 17-28 (1983) (5) Laquer FC, Manahan SE; Chemosphere 16: 1431-45 (1987) (6) Briggs GG; J Agric Food Chem 29: 1050-9 (1981) (7) Boyd SA et al; Appl Environ Microbiol 46: 50-4 (1983) (8) Luh MD, Baker RA; pp. 534-42 in Proc 25th Ind Waste Conf Purdue Univ (1970) (9) Lide DR, ed; CRC Handbook of Chemistry and Physics. 81st Ed. Boca Raton, FL: CRC Press LLC, p. 5-89 (2000) (10) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Vapor Pressure
PressureReference
0.35 mm Hg @ 25 deg CJones AH; J Chem Eng Data 5: 196-200 (1960)
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaEscherichia ColiNANADixon et al. 2022
ProkaryotaEnterobacter CloacaeNANAJünger et al. 2012
ProkaryotaEscherichia ColiNANAJünger et al. 2012
ProkaryotaSerratia MarcescensNANAJünger et al. 2012
ProkaryotaStaphylococcus AureusLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaPseudomonas AeruginosaLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
EukaryotaChaetomium IndicumNAMoisan et al. 2021
EukaryotaTrichoderma VirideNAMoisan et al. 2021
ProkaryotaPseudomonas Protegensinhibite the growth of Heterobasidion abietinum 10 and several fungi of different species (Basidiomycete, Ascomycete, Oomycota, Zygomycota)NAPrigigallo et al. 2021
ProkaryotaBacillus Subtilispromote biomass production of Arabidopsis thalianarhizosphere of Haloxylon ammodendronHe et al. 2023
ProkaryotaKlebsiella Pneumoniaen/aNASchulz and Dickschat 2007
ProkaryotaCitrobacter Freundiin/aNASchulz and Dickschat 2007
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/aNASchulz and Dickschat 2007
ProkaryotaBacillus SimplexReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaBacillus SubtilisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaBacillus WeihenstephanensisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaMicrobacterium OxydansReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaStenotrophomonas MaltophiliaReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaStreptomyces LateritiusReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaSerratia MarcescensReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.NAGu et al. 2007
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/aNADickschat et al. 2005_3
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
ProkaryotaChromobacterium Violaceumn/aNABlom et al. 2011
ProkaryotaPandoraea Norimbergensisn/aNABlom et al. 2011
ProkaryotaBurkholderia Gladiolin/aNABlom et al. 2011
ProkaryotaBurkholderia Tropican/aNABlom et al. 2011
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
ProkaryotaSerratia Sp.NANAAlmeida et al. 2022
EukaryotaAureobasidium PullulansNANAMozūraitis et al. 2022
EukaryotaCryptococcus WieringaeNANAMozūraitis et al. 2022
EukaryotaHanseniaspora UvarumNANAMozūraitis et al. 2022
EukaryotaPichia KudriavzeviiNANAMozūraitis et al. 2022
EukaryotaPichia FermentansNANAMozūraitis et al. 2022
EukaryotaPichia KluyveriNANAMozūraitis et al. 2022
EukaryotaPichia MembranifaciensNANAMozūraitis et al. 2022
EukaryotaSaccharomyces ParadoxusNANAMozūraitis et al. 2022
EukaryotaTorulaspora DelbrueckiiNANAMozūraitis et al. 2022
EukaryotaPichia AnomalaNANAMozūraitis et al. 2022
EukaryotaMetschnikowia PulcherrimaNANAMozūraitis et al. 2022
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaLactobacillus PlantarumNANAZhang et al. 2022
EukaryotaWickerhamomyces AnomalusNANAShi et al. 2022
ProkaryotaBacillus SubtilisNANALee et al. 2023
Bacillus ThuringiensisKoilybayeva et al. 2023
Bacillus ToyonensisKoilybayeva et al. 2023
Bacillus AcidiproducensKoilybayeva et al. 2023
Bacillus CereusKoilybayeva et al. 2023
Bacillus SafensisKoilybayeva et al. 2023
Citrobacter FreundiiTallon et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaEscherichia ColiLBTD/GC-MSno
ProkaryotaEnterobacter CloacaeColumbia sheep bloodTD/GC-MS and MCC-IMSno
ProkaryotaEscherichia ColiColumbia sheep bloodTD/GC-MS and MCC-IMSno
ProkaryotaSerratia MarcescensColumbia sheep bloodTD/GC-MS and MCC-IMSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTSB mediaHS-SPME/GC-MSno
EukaryotaChaetomium Indicum1/5th PDA mediumGC-MSno
EukaryotaTrichoderma Viride1/5th PDA mediumGC-MSno
ProkaryotaPseudomonas ProtegensLB agar/PD agarGC-MSyes
ProkaryotaBacillus Subtilis1/2 MS mediaSPME/GC-MSno
ProkaryotaKlebsiella Pneumoniaen/an/ano
ProkaryotaCitrobacter Freundiin/an/ano
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/an/ano
ProkaryotaBacillus Simplexn/an/ano
ProkaryotaBacillus Subtilisn/an/ano
ProkaryotaBacillus Weihenstephanensisn/an/ano
ProkaryotaMicrobacterium Oxydansn/an/ano
ProkaryotaStenotrophomonas Maltophilian/an/ano
ProkaryotaStreptomyces Lateritiusn/an/ano
ProkaryotaSerratia Marcescensn/an/ano
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/an/ano
EukaryotaTuber Aestivumn/an/ano
ProkaryotaChromobacterium ViolaceumLBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPandoraea NorimbergensisLBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GladioliMR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia TropicaMR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
ProkaryotaSerratia Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
EukaryotaAureobasidium PullulansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaCryptococcus WieringaeYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaHanseniaspora UvarumYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KudriavzeviiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia FermentansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KluyveriYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia MembranifaciensYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaSaccharomyces ParadoxusYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaTorulaspora DelbrueckiiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia AnomalaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaMetschnikowia PulcherrimaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaLactobacillus Plantarumchickpea milkUHPLC/MSno
EukaryotaWickerhamomyces Anomalusmedium consisted of glucose (20 g/l), peptone (5 g/l), agar (20 g/l) and amoxicillin (1 g/l)SPME with GC-MSno
EukaryotaWickerhamomyces Anomalussolid-state fermentation starter culture DaquSPME coupled with GC-MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno
Bacillus Thuringiensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Toyonensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Acidiproducensbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Cereusbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Safensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Citrobacter Freundiitryptone soya broth (TSB) mediaSPME/GC/MSno


Compound Details

Synonymous names
toluene
methylbenzene
108-88-3
toluol
Phenylmethane
methacide
methylbenzol
Benzene, methyl-
antisal 1a
Toluen
tolu-sol
Methane, phenyl-
Tolueen
Toluolo
phenyl methane
1-Methylbenzene
monomethyl benzene
RCRA waste number U220
Tolueno
methyl-Benzene
Caswell No. 859
p-toluene
NCI-C07272
CP 25
CCRIS 2366
HSDB 131
NSC 406333
UN 1294
4-methylbenzene
Benzene, methyl
EINECS 203-625-9
UNII-3FPU23BG52
EPA Pesticide Chemical Code 080601
NSC-406333
3FPU23BG52
DTXSID7021360
CHEBI:17578
AI3-02261
TOLUENE (RING-D5)
CHEMBL9113
DTXCID501360
EC 203-625-9
Toluene, anhydrous
MFCD00008512
NCGC00090939-02
TOLUENE (IARC)
TOLUENE [IARC]
TOLUENE (MART.)
TOLUENE [MART.]
TOLUENE (USP-RS)
TOLUENE [USP-RS]
Tolueen [Dutch]
Toluen [Czech]
Toluene, analytical standard
Tolueno [Spanish]
Toluolo [Italian]
methyl benzene
para-toluene
Methyl benzol
Toluene, ACS reagent, >=99.5%
Toluene 1000 microg/mL in Methanol
CAS-108-88-3
RAMIPRIL IMPURITY G (EP IMPURITY)
RAMIPRIL IMPURITY G [EP IMPURITY]
PHME
UN1294
RCRA waste no. U220
methylbenzenes
Dracyl
phenyl-methane
toluene solvent
2-methylbenzene
toluene-
Methylbenzene; Toluene; Ramipril Imp. G (EP); Ramipril Impurity G
MePh
2-methyl benzene
4-methyl-benzene
Toluene ACS Grade
Toluene HPLC grade
Methylbenzene, 9CI
Toluene (Technical)
Toluene, for HPLC
PhCH3
Toluene, ACS reagent
Toluene, HPLC Grade
4i7k
TOLUENE [HSDB]
TOLUENE [INCI]
Toluene, 99.5%
TOLUENE [MI]
CP 25 (SOLVENT)
Toluene, Environmental Grade
Toluene, Semiconductor Grade
Toluene, LR, >=99%
C6H5CH3
TOLUENE [GREEN BOOK]
WLN: 1R
BIDD:ER0288
Toluene, anhydrous, 99.8%
Toluene, ASTM, 99.5%
Toluene, p.a., 99.5%
GTPL5481
Toluene, AR, >=99.5%
Toluene, for HPLC, 99.9%
Toluene, LR, rectified, 99%
CHEBI:38975
DTXSID00184990
DTXSID50175878
Toluene, HPLC grade, 99.8%
Toluene, Spectrophotometric Grade
Toluene 10 microg/mL in Methanol
Toluene, LR, sulfur free, 99%
Toluene, AR, rectified, 99.5%
Toluene, technical grade, 95.0%
BCP16202
Toluene, for HPLC, >=99.8%
Toluene, for HPLC, >=99.9%
Toluene, histology grade, practical
Toluene, PRA grade, >=99.8%
Toluene 100 microg/mL in Methanol
Tox21_111042
Tox21_201224
BDBM50008558
NSC406333
Toluene, purification grade, 99.8%
AKOS015840411
DB11558
MCULE-4817136027
Toluene, anhydrous, (water < 50ppm)
Toluene, puriss., >=99.5% (GC)
Toluene, SAJ first grade, >=99.0%
NCGC00090939-01
NCGC00090939-03
NCGC00258776-01
Toluene [UN1294] [Flammable liquid]
Toluene, JIS special grade, >=99.5%
Toluene, Laboratory Reagent, >=99.3%
Toluene, for HPLC, >=99.7% (GC)
Toluene, UV HPLC spectroscopic, 99.5%
Toluene, anhydrous, ZerO2(TM), 99.8%
DB-309420
NS00008096
T0260
Toluene, suitable for determination of dioxins
C01455
Q15779
Toluene, suitable for scintillation, >=99.7%
Toluene liquid density, NIST(R) SRM(R) 211d
A801937
SR-01000944565
Toluene, ACS spectrophotometric grade, >=99.5%
SR-01000944565-1
Toluene, p.a., ACS reagent, reag. ISO, 99.5%
InChI=1/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H
D5191 Vapor Pressure - 7.1kPa (1.03 psi), 10 x 10 mL
Toluene, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.5%
Toluene, absolute, over molecular sieve (H2O <=0.005%), >=99.7% (GC)
Toluene, Pharmaceutical Secondary Standard; Certified Reference Material
Residual Solvent - Toluene, Pharmaceutical Secondary Standard; Certified Reference Material
Toluene, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.7% (GC)
25013-04-1
Microorganism:

Yes

IUPAC nametoluene
SMILESCC1=CC=CC=C1
InchiInChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
FormulaC7H8
PubChem ID1140
Molweight92.14
LogP2.7
Atoms7
Bonds0
H-bond Acceptor0
H-bond Donor0
Chemical Classificationalkylbenzenes aromatic compounds benzenoids
CHEBI-ID17578
Supernatural-IDSN0462728

mVOC Specific Details

Boiling Point
DegreeReference
110.6 °C peer reviewed
Volatilization
The Henry's Law constant for toluene is 6.64X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that toluene is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 2.9 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 3.8 days(SRC). Toluene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Toluene is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 28.4 mm Hg(3). The air-water interface equilibrium partitioning coefficient for toluene, at a concentration of 0.47 mg/L, has been reported to be 0.223, 0.226, 0.273, and 0.336 at 26.9, 31.9, 36.9, and 41.9 deg C, respectively(4). A first-order volatilization rate calculated for toluene from water using an inverse reactive simulation was reported as 6.62X10-6/sec(5). The volatilization half-life of toluene from a water column of one meter depth was estimated to be 5.18 hours(6). Toluene was reported to have a disappearance half-life of <2 days due to volatilization in two different soil types, a Captina silt loam and a McLaurin sandy loam(7).
Literature: (1) Mackay D et al; Environ Sci Technol 13: 333-6 (1979) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1989) (4) Cheng W-H et al; Atmos Environ 37: 4807-4815 (2003) (5) Keefe SH et al; Environ Sci Technol 38: 2209-2216 (2004) (6) Mackay D, Leinonen PJ; Environ Sci Technol 9: 1178-80 (1975) (7) Anderson TA et al; J Environ Qual 20:420-4 (1991)
Soil Adsorption
The Koc of toluene was reported as 178 in a sandy soil(1) and as 37 (Wendover silty loam), 160 (Grimsby silt loam), 160 (Vaudreil sandy loam) and 46 (sandy soil)(2). The Koc of toluene in lake sediment was measured as 166(3). According to a classification scheme(4), these measured Koc values suggest that toluene is expected to have high to moderate mobility in soil.
Literature: (1) Wilson JT et al; J Environ Qual 10: 501-6 (1981) (2) Nathwani JS, Phillips CR; Chemosphere 6: 157-62 (1977) (3) Kan AT et al; Environ Sci Technol 32: 892-902 (1998) (4) Swann RL et al; Res Rev 85: 17-28 (1983)
Literature: #In association with clay minerals, toluene's adsorption is inversely proportional to the pH of the soil. Approximately 40-70% of toluene applied to the surface of sandy soils is volatilized.
Literature: IARC. Monographs on the Evaluation of the Carcinogenic Risk of Chemicals to Humans. Geneva: World Health Organization, International Agency for Research on Cancer, 1972-PRESENT. (Multivolume work). Available at: http://monographs.iarc.fr/ENG/Classification/index.php, p. V47: 90 (1989)
Vapor Pressure
PressureReference
28.4 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANAHewett et al. 2020
EukaryotaAspergillus NigerNANACosta et al. 2016
EukaryotaCandida AlbicansNANACosta et al. 2016
EukaryotaPenicillium ChrysogenumNANACosta et al. 2016
ProkaryotaPseudomonas AeruginosaNANANA
EukaryotaAspergillus FlavusITEM collection of CNR-ISPA (Research National Council of Italy - Institute of Sciences of Food Production) in Bari, ItalyJosselin et al. 2021
ProkaryotaPseudomonas Pseudoalcaligenespromotes the growth of Zea mays L. and confer the resistance to drought stress in this maizeApplied Microbiology and Biotechnology lab, Department of Biosciences, Comsats University IslamabadYasmin et al. 2021
EukaryotaCandida AlbicansATCC MYA-2876, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida GlabrataATCC 90030, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida TropicalisATCC 750, American Type Culture CollectionCosta et al. 2020
EukaryotaAntrodia CinnamomeananaLu et al. 2014
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
ProkaryotaSerratia Proteamaculansn/aNAErcolini et al. 2009
ProkaryotaCarnobacterium Divergensn/aNAErcolini et al. 2009
ProkaryotaPseudomonas Fragin/aNAErcolini et al. 2009
EukaryotaTuber Excavatumn/aFortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Borchiin/aFortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Aestivumn/aFortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Brumalen/aFortywoodland of the Basilicata regionMauriello et al. 2004
ProkaryotaBurkholderia Tropican/aNATenorio-Salgado et al. 2013
ProkaryotaBurkholderia Sp.bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
ProkaryotaPaenibacillus Sp.bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
ProkaryotaAchromobacter Sp.NANAAlmeida et al. 2022
ProkaryotaSerratia Sp.NANAAlmeida et al. 2022
EukaryotaAureobasidium PullulansNANAMozūraitis et al. 2022
EukaryotaCryptococcus WieringaeNANAMozūraitis et al. 2022
EukaryotaHanseniaspora UvarumNANAMozūraitis et al. 2022
EukaryotaPichia KudriavzeviiNANAMozūraitis et al. 2022
EukaryotaPichia FermentansNANAMozūraitis et al. 2022
EukaryotaPichia KluyveriNANAMozūraitis et al. 2022
EukaryotaPichia MembranifaciensNANAMozūraitis et al. 2022
EukaryotaSaccharomyces ParadoxusNANAMozūraitis et al. 2022
EukaryotaTorulaspora DelbrueckiiNANAMozūraitis et al. 2022
EukaryotaPichia AnomalaNANAMozūraitis et al. 2022
EukaryotaMetschnikowia PulcherrimaNANAMozūraitis et al. 2022
Kluyveromyces MarxianusJi et al. 2024
Mycobacterium UlceransChudy et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBSPME/GC-MSno
EukaryotaAspergillus NigerYeast Glucose ChloramphenicolSPME/GCxGC-MSno
EukaryotaCandida AlbicansYeast Glucose ChloramphenicolSPME/GCxGC-MSno
EukaryotaPenicillium ChrysogenumYeast Glucose ChloramphenicolSPME/GCxGC-MSno
ProkaryotaPseudomonas Aeruginosatrypticase soy agarTD/GC-MSno
EukaryotaAspergillus FlavusSNA mediaSPME/GC-MSno
ProkaryotaPseudomonas PseudoalcaligenesLB mediaSPME/GC-MSno
EukaryotaCandida AlbicansYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida GlabrataYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida TropicalisYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaAntrodia CinnamomeaPDAGC/MSyes
EukaryotaTuber Aestivumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MSno
ProkaryotaSerratia Proteamaculansn/an/ano
ProkaryotaCarnobacterium Divergensn/an/ano
ProkaryotaPseudomonas Fragin/an/ano
EukaryotaTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
ProkaryotaBurkholderia TropicaPotato dextrose agarHeadspace trapping/ GC-MSno
ProkaryotaBurkholderia Sp.TSBAGC-Q-TOFno
ProkaryotaPaenibacillus Sp.TSBAGC-Q-TOFno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaAchromobacter Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaSerratia Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
EukaryotaAureobasidium PullulansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaCryptococcus WieringaeYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaHanseniaspora UvarumYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KudriavzeviiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia FermentansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KluyveriYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia MembranifaciensYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaSaccharomyces ParadoxusYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaTorulaspora DelbrueckiiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia AnomalaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaMetschnikowia PulcherrimaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
Kluyveromyces MarxianusSauce Meat during StorageSPME–GC–MSno
Mycobacterium UlceransNAGCMS–GP2010no


Methane

Compound Details

Synonymous names
02329_FLUKA
0CB689EE-132E-4559-A597-C79A40192203
14493-06-2
150036-83-2
295477_ALDRICH
3B4-2254
463035_ALDRICH
490210_ALDRICH
74-82-8
8006-14-2
AC1L18XA
AC1Q2825
AG-E-08601
AKOS005166816
AR-1A0383
AR-1A0497
Biodiesels
Biogas
BRN 1718732
C01438
C5M
CH4
CHEBI:16183
CHEMBL17564
CTK2H7747
Fire Damp
HSDB 167
KST-1A1445
KST-1A1563
Marsh gas
metano
methan
methane
Methane in gaseus state
Methane-12C
Methyl hydride
MolPort-018-618-244
Natural gas
OP0UW79H66
R 50
R 50 (refrigerant)
tetrahydridocarbon
UN1971
UN1972
UNII-OP0UW79H66
GLASSY CARBON
Nanotubes, Carbon
Carbonmesopor
EINECS 200-812-7
Carbon (graphite)
Nanodiamond (particle size :
DTXSID8025545
EC 200-812-7
4-01-00-00003 (Beilstein Handbook Reference)
Graphene quantum dots
Graphene film, monolayer, on copper foil (1cm x 1cm)
Carbon; Charcoal activated
METHANE (EP MONOGRAPH)
METHANE [EP MONOGRAPH]
6532-48-5
carbon fiber
MFCD00133992
MFCD00144065
MFCD00146977
MFCD00211867
MFCD09753896
MFCD31654066
Single-walled carbon nanotubes (SWNTs)
Methylidyne radical
CVD Graphene on Si 1cmx1cm(3-5 layers)
High Purity Single-walled Carbon Nanotubes
Multi-walled carbon nanotubes (MWNTs), 95+%
Graphitized Multi-Walled Carbon Nanotubes 8-15nm
Graphitized Hydroxy Multi-Walled Carbon Nanotubes 8-15nm
Hydroxy Double-Walled Crabon Nanotubes (DWNTs-OH) 2-4nm
Total Organic Carbon Standard: TOC @ 1000 mg/L in H2O
thin graphene
Carbon,mesopor
acetylene carbon
Carbon dots
Carbon Granules
Carbon Nanorods
Thiol Graphene
a methyl group
Carbon Fabric
Carbon Pieces
Carbon Slugs
Graphene Kit
Carbon Foam
Carbon Nanofiber
Carbon Nanohorns
GO quantum dots
Gas, natural
Carbon Electrodes
Mesoporous Carbon
monohydride carbon
Carbon NanoFibers
N-doped Graphene
N-doped Grpahene
Carbon nano fibers
Carbon quantum dot
Carbon black, CP
high purity SWNTs
Multiwall Nanotubes
Carbon rods, 5N
N-doped MWCNTs
74C
Fullerene C-70
Carbon Nanotube Ink
Carbon Quantum Dots
Fluorinated Graphene
MWCNTs water paste
Carbon, decolorizing
Graphene oxide flake
Aqua Graphene slurry
Fullerene - C70
CARBONEUM
Flash-ignited MWNTs
Electrode pole pieces
Graphene oxide powder
Graphite oxide powder
Liquified natural gas
Synthetic natural gas
Carbon Conductive Ink
rGO-NH-Carboimidazole
Carbon Graphite Plates
Conductive carbon black
MWNTs water suspension
Carbon Black Nanopowder
GO quantum dots powder
Nitrogen doped CMK-3
Graphene oxide, reduced
Graphene slurry in NMP
MWNTs DMSO suspension
PEG@GO
PEI@GO
Carbon nitride catalysts
Carboxyl Graphene powder
MWCNTs water suspension
Graphene slurry in water
METHANE [HSDB]
CARBONEUM [HPUS]
GO quantum dots(Powder)
METHANE [MI]
MWCNTs(long) 4-6nm
Carbon Dots Bright Green
Carbon Quantum Dots Blue
Tunable Nanoporous Carbon
BLACK 2
Carbon Fiber Cloth Fabric
Carbon Nanorods Properties
Carboxyl Carbon Dots Blue
FluorinatedCarbon Nanotubes
MWNTs(short) 4-6 nm
NanoIntegris Dielectic ink
GrapheitizedMWNT 8-15nm
MWCNTs(long) 5-15nm
Carbon Black Nanodispersion
Disodered Mesoporous Carbon
GO quantum dots (solvent)
BLACK 2 [INCI]
Carbon, 200 mesh,Powder
DC BLACK NO. 2
Grapheitized MWNTs >50nm
Graphene quantum dots green
Methane, >=99.0%
Customized MWNTs dispersion
Reduced Graphene Oxide@ Ag
Carbon Conductive Ink Paste
Carbon nanotubes DMF slurry
Carbon nanotubes NMP slurry
Double-wall carbon nanotubes
GO quantum dots(20mg/ml)
Graphene Nanoplate 1-5 nm
Graphene slurry H:3-10nm
Methane, analytical standard
MWNTs(short) 5-15 nm
MWNTs(short) 8-15 nm
Single layer graphene powder
4QQN74LH4O
CARBON BLACK [HSDB]
CARBON BLACK [IARC]
CARBON BLACK [INCI]
CH2H2
CMK-3
CMK-8
Double-walledcarbon nanotubes
GCB graphitized carbon black
Graphene Dispersion in water
Graphene nanoplates 1-5 nm
MWCNTs(long) 20-30nm
MWCNTs(long) 8-15 nm
UNII-6GRV67N0U2
Carbon Nanofibers Graphitized
Graphene Oxide Carboimidazole
Industrial Graphene Nanoplate
Nano Carbon Black Dispersion
Single Wall Carbon Nanohorns
Soot Carbon Black Nanopowder
Carbon, 99.5%,30nm
Graphene Nanoplate 3-10 nm
MWNTs(short) 20-30 nm
MWNTs(short) 30-50 nm
Nanointegris ultrapure SWCNTs
UN 1971 (Salt/Mix)
UN 1972 (Salt/Mix)
Carboxyl Graphene quantum dots
Customized Graphene Dispersion
Graphene quantum dots(Powder)
Graphitized MWNTs 10-20nm
Low Purity Carboxylic SWCNTs
Multiwall Nanotubes 5-15 nm
N-doped Graphene quantum dots
GO quantum dots(C: 1mg/ml)
Grapheitized MWNTs 20-30nm
Grapheitized MWNTs 30-50nm
Low purity Hydroxylate SWCNTs
Megnetic Graphene Oxide powder
MWNTs ethyl acetate suspension
Reduced Graphene Oxide@ SnO2
Thin Layer Graphene Nanoplates
Carbon nanotubes aqueous slurry
Carboxylate Graphene Dispersion
Fullerene soot, (as produced)
Laser Scribed Graphene (LSG)
Multiwall Nanotubes-OH Hydroxy
MWNTs Butyl acetate suspension
UNIPURE BLACK LC 902
4XYU5U00C4
6GRV67N0U2
Carboxyl MWCNTs(long) <8 nm
Carboxyl MWCNTs(long) 4-6nm
DTXCID705545
GO quantum dots yellow(Powder)
Industrial grade MWNTs 50 nm
MWNTs (long) 10-20 nm
Graphene electric aqueous slurry
Graphene Film(Filtering method)
Graphene powder Physical methods
Reduced Graphene Oxide@ Co3O4
Reduced Graphene Oxide@ Fe3O4
Singlewall Nanotubes-OH Hydroxy
Carbon Conductive Adhesive Tapes
Carbon Nanotube sponges XFCN01
Carbon Nanotube sponges XFCN07
Carbon Nanotube sponges XFCN08
Carboxyl MWCNTs(short) 4-6nm
CHEMBL2106049
Diamond Synthesized, 95% Nano
Diethyl Cyanomethyl Phosphonate
Graphene Sponges(Foams,Aerogel)
Industrial Graphene Oxide Powder
Carbon conductive cement adhesive
Conductive Flexible TPU Filament
GO quantum dots yellow(1mg/ml)
High Purified Carboxylic SWCNTS
Ultrapure SWCNTs NMP dispersion
Amino Graphene quantum dot powder
Carbon black, Super P Conductive
DTXSID50179391
DTXSID60176836
Graphene Sponges (Foams,Aerogel)
High Purified Hydroxylate SWCNTS
Lowpurity hydroxy SWCNTs (long)
NanoIntegris metallic SWCNTs70%
NanoIntegris metallic SWCNTs90%
NanoIntegris metallic SWCNTs95%
VEGETABLE CARBON [MART.]
Vitamin C Reduced Graphene Oxide
Lowpurity carboxyl SWCNTs (long)
Megnetic Graphene Oxide dispersion
Carbon nanotubes isopropanol slurry
CI 77266 [INCI]
D&C BLACK NO. 2 [II]
Industrial grade MWNTs 10-20nm
Industrial grade MWNTs 20-30nm
Industrial grade MWNTs 50-60nm
Industrial grade MWNTs 8-15 nm
Industrial grade MWNTs 9-16 nm
Industrial Thin Graphene Nanoplate
MWNTs isopropyl alcohol suspension
Carboxyl MWCNTs(short) 5-15 nm
Carboxyl MWCNTs(short) 8-15 nm
Graphene Powder with small diameter
Graphene quantum dots(C: 1mg/ml)
Industrial grade MWCNTs 8-15 nm
Isotopic 13C Graphene on Cu Foil
Large diameter graphene oxide sheet
NanoIntegris metallic SWCNTs 98%
NanoIntegris metallic SWCNTs 99%
AMY33424
Carbon powder, 99.999%, 5N
Graphene Oxide dispersion <500 nm
Graphene Oxide dispersion >500 nm
Heat Dissipation Graphene Oxide Mud
HelicalMulti-walled carbon nanotubes
High purity SWNTs 0.7-2.5 nm
Highpurity carboxyl SWCNTs (short)
Industrial grade MWNTs 13-17 nm
Industrial Grade MWNTs 20-40 nm
Largeinner diameter thin-wall MWNTs
Monolayer Graphene on SiC substrate
Ultrapure SWCNTs aqueous dispersion
UNIPURE BLACK LC 902 GRAN
VEGETABLE CARBON (E 153)
EINECS 232-343-9
EINECS 240-383-3
Graphene quantum dots(MC: 1mg/ml)
Graphite flake, natural, -10 mesh
Graphite ink for tantalum capacitors
High purity carboxyl SWCNTs (long)
Aligned Multi-walled carbon nanotubes
Carboxyl Graphene dispersion <500nm
Carboxyl Graphene quantum dots powder
Diamond Powder (gray), 97+% Nano
Diamond Powder (gray), 98+% Nano
Grapheitized Carboxyl MWNTs >50 nm
Grapheitized Carboxyl MWNTs 8-15nm
GrapheitizedCarboxyl MWNTs 10-20nm
GrapheitizedCarboxyl MWNTs 20-30nm
GrapheitizedCarboxyl MWNTs 30-50nm
Graphite flake, median 7-10 micron
Graphite powder, <20 um, synthetic
Helical Multi-walled carbon nanotubes
MFCD06411993
MFCD07370731
NA1361
NanoIntegris SWCNTs with high purity
Carbon nanotubes butyl butyrate slurry
CVD Graphene Film on Nickel 5cmx5cm
Graphene oxide dispersion 1-5 layers
Graphene quantum dots red fluorescence
Graphite flake, natural, -325 mesh
Hydroxylate MWNTs(short) 30-50 nm
Raw Plasma Nanotubes Powder RN-020
CVD Graphene on Si 1cmx1cm(Bilayer)
Diamond powder, synthetic, <1 micron
Grapheitized Hydroxylate MWNT 8-15nm
GrapheitizedHydroxylate MWNTs >50 nm
Graphene Oxide Film(Filtering method)
Graphite foil, 1mm (0.04in) thick
Industrial Carboxylic SWCNTs 1-2 nm
Single Layer Graphene dispersion water
Single walled Carbon Nanotubes on PET
Amination multi-walled carbon nanotubes
CVDGraphene on SiO2 5cmx5cm(Bilayer)
DB09278
GrapheitizedHydroxylate MWNTs 10-20nm
GrapheitizedHydroxylate MWNTs 30-50nm
Graphene Oxide dispersion water or NMP
Graphite rod, 5.0mm (0.20in) dia
HIPCO pure Metallic Hipco SWNTs solid
Industrial Hydroxylate SWCNTs 1-2 nm
N-doped MWCNTs (N Content2.98wt%)
NanoIntegris metallic SWCNTs70% solid
NanoIntegris metallic SWCNTs90% solid
NanoIntegris metallic SWCNTs95% solid
Carbon felt, 1.27cm (0.5in) thick
Carbon felt, 2.54cm (1.0in) thick
Carboxylic Multi-walled Carbon Nanotubes
CarboxylicDouble walled carbon nanotubes
CVD Graphene on Si 1cmx1cm(Monolayer)
Graphite plate, 2.5cm (1.0in) thick
HIPCO Semiconducting Hipco SWNTs solid
Imported Reduced Graphene Oxide@ Fe3O4
N-doped MWCNTS (N Content3.00wt%)
Nanoinnova Graphene Oxide-Carboimidazole
NanoIntegris semiconductive SWCNTs 90%
NanoIntegris semiconductive SWCNTs 95%
NanoIntegris semiconductive SWCNTs 98%
NanoIntegris semiconductive SWCNTs 99%
Ultrapure Single-walled carbon nanotubes
Aminated Graphene TEPA covalently linked
Carbon black, acetylene, 50% compressed
Carbon felt, 6.35mm (0.25in) thick
Carboxyl MWCNTs water paste (~10wt%)
CVD Graphene on Glass 1cmx1cm(Bilayer)
CVD Graphene on SiO2 1cmx1cm(Bilayer)
CVD Graphene on SiO2 2cmx2cm(Bilayer)
CVD Graphene on SiO2 7cmx7cm(Bilayer)
CVDGraphene on SiO2 5cmx5cm(Monolayer)
Diamond Powder (black), 52-65% Nano
Grapheitized Hydroxylate MWNTs 20-30nm
Graphite foil, 0.5mm (0.02in) thick
Graphite rod, 10.0mm (0.40in) dia
High Purified Large Surface Area SWCNTS
Industrial Few Layer Graphene Nanoplates
Multiwall Nanotubes-OH Hydroxy 5-15 nm
NanoIntegris metallic SWCNTs 98% solid
NanoIntegris metallic SWCNTs 99% solid
Reduced Graphene Oxide-NH-Carboimidazole
SingleWalled Carbon nanotubes NMP slurry
4H-Pyrrolo[1,2-d][1,4]oxazocine-9-carboxaldehyde,1,2,5,6-tetrahydro-6-hydroxy-4,5-dimethyl-2-oxo-, (4R,5R,6S)-rel-
Carboxyl MWCNTs water paste (~2.7wt%)
CVD Graphene on Quartz 1cmx1cm(Bilayer)
Graphite plate, 1.27cm (0.5in) thick
High-Ni Calibration series, O 38x15 mm
HIPCO pure Metallic Hipco SWNTs Aqueous
HIPCO Semiconducting Hipco SWNTs Aqueous
Methane, electronic grade, >=99.998%
Monolayer Graphene Powder Chemical method
N-doped Graphene Sponges (Foams,Aerogel)
P-doped Graphene Sponges (Foams,Aerogel)
PD053877
Preservative Reduce Graphene Oxide Powder
Purified Plasma Nanotubes Powder RN-220
Short ultrapure SWCNTs aqueous dispersion
Ultrapure Short SWCNTs aqueous dispersion
Acetylene carbon black (100% compressed)
Carbon felt, 3.18mm (0.125in) thick
CarboxylDouble-wall carbon nanotubes(long)
CVD Graphene on Glass 1cmx1cm(Monolayer)
CVD Graphene on Plastic 1cmx1cm(Bilayer)
CVD Graphene on Si 1cmx1cm(6-8 layers)
CVD Graphene on SiO2 1cmx1cm(Monolayer)
CVD Graphene on SiO2 2cmx2cm(Monolayer)
CVD Graphene on SiO2 7cmx7cm(Monolayer)
Diamond powder, synthetic, 40-60 micron
Graphite foil, 0.4mm (0.015in) thick
Graphite Oxide powder prepared by S method
Graphite Powders, 99.9% (metals basis)
High Purified Single-walled carbonnanotubes
HighPurified Single-walled carbon nanotubes
Hydroxy Graphene quantum dots(C: 1mg/ml)
Industrial grade carboxylation MWNTs 50nm
Methane, Messer(R) CANGas, 99.999%
Multi-walled carbon nanotubes(long) >50nm
Multiwalled carbon nanotube DMF dispersion
NanoIntegris semiconductive SWCNTs 99.9%
Purified Amio Single-walled carbonnanotubes
Aminated Graphene quantum dots(C: 1mg/ml)
B-doped Graphene Sponges (Foams, Aerogels)
Carbon Nanotubes Thermal Radiation Coatings
Carboxyl Double-wall carbon nanotubes(long)
Carboxyl Graphene quantum dots(C: 1mg/ml)
CVD Graphene on Quartz 1cmx1cm(Monolayer)
CVD Graphene on Si 2.5cmx2.5cm(Bilayer)
CVDGraphene on SiO2 5cmx5cm(3-5 layers)
CVDGraphene on SiO2 5cmx5cm(6-8 layers)
Graphene Oxide dispersion customized service
Graphite foil, 0.13mm (0.005in) thick
Graphite foil, 0.254mm (0.01in) thick
Graphite powder, nickel coated, -100 mesh
Graphite powder, synthetic, -20+100 mesh
Imported loaded nano-gold particles graphene
Multi-walled carbon nanotube DMF dispersion
Single Layer H-BN Film on SIO2 substrate
Carbon nanotubes, single-walled/double-walled
Carbon, mesoporous, hydrophilic pore surface
CVD Graphene on Copper Foil1cmx1cm(Bilayer)
CVD Graphene on Glass 1cmx1cm(3-5 layers)
CVD Graphene on Glass 1cmx1cm(6-8 layers)
CVD Graphene on Plastic 1cmx1cm(Monolayer)
CVD Graphene on SiO2 1cmx1cm(3-5 layers)
CVD Graphene on SiO2 1cmx1cm(6-8 layers)
CVD Graphene on SiO2 2cmx2cm(3-5 layers)
CVD Graphene on SiO2 2cmx2cm(6-8 layers)
CVD Graphene on SiO2 7cmx7cm(3-5 layers)
CVD Graphene on SiO2 7cmx7cm(6-8 layers)
Fluorinated Carbon Nanotubes(F48-50 wt.%)
Fluorinated Carbon Nanotubes(F48-58 wt.%)
Graphene dispersion(C:1mg/ml solvent:water)
Graphene Spones (foams)(Size: 2cmx2cmx2cm)
Graphene Spones (foams)(Size: 5cmx5cmx5cm)
Hydroxylation Single Nanotubes 0.7-2.5 nm
Multi wall carbon nanotubes (MWNTs)>50 nm
Multi-walled carbon nanotubes NMP dispersion
Multi-walled carbon nanotubes(short) >50 nm
NS00004509
NS00081852
NS00093167
Single-walled carbon nanotubes (SWNTs-COOH)
Aminated Graphene Amino-PEG covalently linked
Aminated Graphene Piperazine covalently linked
Carbon nanotubes, multi-walled, core material
Carbon, foil, 5x5mm, thickness 2.0mm, hOpg
Carboxylic ultrapure SWCNTs aqueous dispersion
CVD Graphene on Quartz (1mm1cmx1cm(Bilayer)
CVD Graphene on Quartz 1cmx1cm(3-5 layers)
CVD Graphene on Quartz 1cmx1cm(6-8 layers)
CVD Graphene on Si 2.5cmx2.5cm(Monolayer)
Electric Heating Reduce Graphene Oxide Powder
Graphene dispersion(C:1mg/ml solvent:ethanol)
Graphite powder, synthetic, APS 7-11 micron
Graphite, colloidal, lubricant, aerosol spray
Multi-walled carbon nanotubes (MWNTs), 95%
Multi-walled carbon nanotubes(short) 10-20nm
NanoIntegris semiconductive SWCNTs 90% solid
NanoIntegris semiconductive SWCNTs 95% solid
NiCoated Multi-walled carbon nanotubes >50nm
Carbon, foil, 5x10mm, thickness 2.0mm, hOpg
Carboxyl Graphene quantum dots(Purity: ~80%)
CVD Graphene on Copper Foil 2cmx2cm(Bilayer)
CVD Graphene on Copper Foil 5cmx5cm(Bilayer)
CVD Graphene on Copper Foil1cmx1cm(Monolayer)
CVD Graphene on Plastic 1cmx1cm(3-5 layers)
CVD Graphene on Plastic 1cmx1cm(6-8 layers)
CVD Graphene on Quartz (1mm1cmx1cm(Monolayer)
Dispersion Carboxyl Graphene dispersion >500nm
Double-Walled Crabon Nanotubes (DWNTs) 2-4nm
EC 231-953-2
EC 231-955-3
EC 240-383-3
Glassy carbon rod, 3mm (0.1in) dia, type 1
Glassy carbon rod, 3mm (0.1in) dia, type 2
Glassy carbon rod, 5mm (0.2in) dia, type 1
Glassy carbon rod, 5mm (0.2in) dia, type 2
Graphene dispersion(C:0.5mg/ml solvent:water)
Graphene Quantum Dot Powder(White fluorescence)
Graphene Spones (foams)(Size: D 1cm,H 1cm)
High concentration MWCNTs water paste(~14wt%)
High purity Carboxyl SWCNTs aqueous dispersion
High purity Single-walled carbonnanotubes(long)
Industrial grade carboxylation MWNTs 20-40 nm
Industrial grade hydroxylation MWCNTs 10-30nm
Industrial grade hydroxylation MWCNTs 20-40nm
IsoNanotubes-S 99.9%Pure Semiconducting SWNT
Low purity single-walled carbon nanotubes(long)
Multi-walled carbon nanotubes (MWNTs), 90+%
Multi-walled carbon nanotubes(short) 30-50 nm
Q37129
Short-hydroxylate multi-walled carbon nanotubes
Single Layer Graphene on PET 1cmx1cm(Bilayer)
Single Layer Graphene on PET 2cmx2cm(Bilayer)
Single Layer Graphene on PET 5cmx5cm(Bilayer)
Sulfur-doped graphene sponges (S-GS,,Aerogel)
Carbon, foil, 10x10mm, thickness 2.0mm, hOpg
Carbon, foil, 15x15mm, thickness 2.0mm, hOpg
Chlorine-based Graphene quantum dots(C: 1mg/ml)
CVD Graphene on Copper Foil 10cmx10cm(Bilayer)
CVD Graphene on Copper Foil 10cmx5cm(Bilayer)
CVD Graphene on Copper Foil 15cmx10cm(Bilayer)
CVD Graphene on Copper Foil 2cmx2cm(Monolayer)
CVD Graphene on Copper Foil 30cmx20cm(Bilayer)
CVD Graphene on Copper Foil 5cmx5cm(Monolayer)
CVD Graphene on Si 2.5cmx2.5cm(3-5 layers)
CVD Graphene on Si 2.5cmx2.5cm(6-8 layers)
Glassy carbon rod, 1mm (0.04in) dia, type 1
Glassy carbon rod, 1mm (0.04in) dia, type 2
Glassy carbon rod, 2mm (0.08in) dia, type 1
Glassy carbon rod, 2mm (0.08in) dia, type 2
Glassy carbon rod, 4mm (0.16in) dia, type 1
Glassy carbon rod, 4mm (0.16in) dia, type 2
Glassy carbon rod, 6mm (0.24in) dia, type 1
Glassy carbon rod, 6mm (0.24in) dia, type 2
Glassy carbon rod, 7mm (0.28in) dia, type 1
Glassy carbon rod, 7mm (0.28in) dia, type 2
Graphene dispersion(C:0.5mg/ml solvent:ethanol)
High Purity Single-walled carbonnanotubes(short)
Imported loaded nano-Palladium particles graphene
Low purity single-walled carbon nanotubes(short)
Nano Au (0) particles on reduced Graphene Oxide
Nano Pd (0) particles on reduced Graphene Oxide
NanoIntegris semiconductive SWCNTs 99.9% solid
Ni Coated Multi-walled carbon nanotubes 8-15nm
Ni Coated Multi-walled carbon nanotubes20-30nm
Ni Coated Multi-walled carbon nanotubes30-50nm
Single Layer Graphene on PET 10cmx5cm(Bilayer)
Single Layer Graphene on PET 1cmx1cm(Monolayer)
Single Layer Graphene on PET 2cmx2cm(Monolayer)
Single Layer Graphene on PET 5cmx5cm(Monolayer)
Super Purified Plasma Nanotubes Powder SPT-220
3D Freestanding Graphene Foam 1cmx1cm(on Nickel)
Aminated Graphene Octadecylamine covalently linked
Carboxyl Multi-walled carbonnanotubes(long) >50nm
Conductive Graphene Filament,3D Printing Materials
CVD Graphene Film on Nickel 1-7 layers ,1cmx1cm
CVD Graphene on Copper Foil 10cmx10cm(Monolayer)
CVD Graphene on Copper Foil 10cmx5cm(Monolayer)
CVD Graphene on Copper Foil 15cmx10cm(Monolayer)
CVD Graphene on Copper Foil 2cmx2cm(3-5 layers)
CVD Graphene on Copper Foil 2cmx2cm(6-8 layers)
CVD Graphene on Copper Foil 30cmx20cm(Monolayer)
CVD Graphene on Copper Foil 5cmx5cm(3-5 layers)
CVD Graphene on Copper Foil 5cmx5cm(6-7 layers)
CVD Graphene on Copper Foil1cmx1cm(3-5 layers)
CVD Graphene on Copper Foil1cmx1cm(6-8 layers)
CVD Graphene on Quartz (1mm1cmx1cm(3-5 layers)
CVD Graphene on Quartz (1mm1cmx1cm(6-8 layers)
Glassy carbon plate, 3mm (0.1in) thick, type 1
Glassy carbon plate, 3mm (0.1in) thick, type 2
Graphite powder, natural, high purity, -200 mesh
Large-Inner Diameter Multi-walled carbon nanotubes
Methane-12C, 13C-depleted, 99.9 atom % 12C
Ni Coated Multi-walled carbon nanotubes 10-20nm
Purified amio single-walled carbon nanotubes 1-2nm
Q866179
Single Layer Graphene on PET 10cmx5cm(Monolayer)
Carbon Nanotube Dispersant / CNTs Water Dispersant
Carbon nanotubes, multi-walled, ground core material
CVD Graphene on Copper Foil 10cmx5cm(3-5 layers)
CVD Graphene on Copper Foil 10cmx5cm(6-8 layers)
Glassy carbon plate, 1mm (0.04in) thick, type 1
Glassy carbon plate, 1mm (0.04in) thick, type 2
Glassy carbon plate, 2mm (0.08in) thick, type 1
Glassy carbon plate, 2mm (0.08in) thick, type 2
Glassy carbon plate, 4mm (0.16in) thick, type 1
Glassy carbon plate, 4mm (0.16in) thick, type 2
Graphitized Multi-Walled Carbon Nanotubes >50 nm
Graphitized Multi-Walled Carbon Nanotubes 10-20nm
Graphitized Multi-Walled Carbon Nanotubes 20-30nm
Graphitized Multi-Walled Carbon Nanotubes 30-50nm
Highly Oriented Pyrolytic Graphite (HOPG-Grade A)
Highly Oriented Pyrolytic Graphite (HOPG-Grade B)
Highly Oriented Pyrolytic Graphite (HOPG-Grade C)
IsoSol-S100 Pure SemiconductingSWNT+Dielectric ink
Q-200950
Q3333711
Q6823951
Single Layer Graphene on PET 1cmx1cm(3-5 layers)
Single Layer Graphene on PET 1cmx1cm(6-8 layers)
Single Layer Graphene on PET 2cmx2cm(3-5 layers)
Single Layer Graphene on PET 2cmx2cm(6-8 layers)
Single Layer Graphene on PET 5cmx5cm(3-5 layers)
Single Layer Graphene on PET 5cmx5cm(6-8 layers)
3D Freestanding Graphene Foam 1cmx1cm(substrate-free)
Bilayer Graphene on SiO2/Si(Size of SiO2: 1cmx1cm)
Bilayer Graphene on SiO2/Si(Size of SiO2: 2cmx2cm)
Carbon Nanotube Dispersant / CNTs Alcohol Dispersant
Carbon, rod, 100mm, diameter 25mm, graphite, 100%
Carbon, rod, 150mm, diameter 25mm, graphite, 100%
Carbon, rod, 50mm, diameter 1.5mm, graphite, 100%
Carbon, rod, 50mm, diameter 25mm, graphite, 100%
Carboxyl Multi-walled carbonnanotubes(long) 30-50 nm
CVD Graphene on Copper Foil 10cmx10cm(3-5 layers)
CVD Graphene on Copper Foil 10cmx10cm(6-8 layers)
CVD Graphene on Copper Foil 15cmx10cm(3-5 layers)
CVD Graphene on Copper Foil 15cmx10cm(6-8 layers)
CVD Graphene on Copper Foil 30cmx20cm(3-5 layers)
CVD Graphene on Copper Foil 30cmx20cm(6-8 layers)
Glassy carbon splinter powder, 20-50 micron, type 1
Graphene Oxide Film Filtering method(size: 4cmX4cm )
Graphene Oxide Film Filtering method(size: 8cmX8cm )
Industrial Grade Multi-walled carbon nanotubes >50 nm
Monolayer Graphene on SiO2/Si(Size of SiO2:1cmx1cm)
Purified Multi-walled carbon nanotubes (MWNTs) <8nm
Q11172462
Single Layer Graphene on PET 10cmx5cm(3-5 layers)
Single Layer Graphene on PET 10cmx5cm(6-8 layers)
Trivial Transfer Graphenetrade mark 1cmx1cm(Bilayer)
Trivial Transfer Graphenetrade mark 1cmx1cm(Monolayer)
Trivial Transfer Graphenetrade mark 5cmx5cm(Bilayer)
Trivial Transfer Graphenetrade mark 5cmx5cm(Monolayer)
Bilayer Graphene on SiO2/Si(Size of SiO2:5cmx1.5cm)
Carbon yarn, woven from 0.076mm (0.003in) dia fibers
Carbon, rod, 100mm, diameter 2.0mm, graphite, 100%
Carbon, rod, 100mm, diameter 3.0mm, graphite, 100%
Carbon, rod, 100mm, diameter 5.0mm, graphite, 100%
Carbon, rod, 150mm, diameter 2.0mm, graphite, 100%
Carbon, rod, 150mm, diameter 3.0mm, graphite, 100%
Carbon, rod, 150mm, diameter 5.0mm, graphite, 100%
Carbon, rod, 25mm, diameter 50mm, graphite, 99.95%
Carbon, rod, 2mm, diameter 0.5mm, graphite, 99.95%
Carbon, rod, 300mm, diameter 2.0mm, graphite, 100%
Carbon, rod, 300mm, diameter 3.0mm, graphite, 100%
Carbon, rod, 300mm, diameter 5.0mm, graphite, 100%
Carbon, rod, 50mm, diameter 25mm, graphite, 99.95%
Carbon, rod, 50mm, diameter 50mm, graphite, 99.95%
Glassy carbon spherical powder, 0.4-12 micron, type 1
Glassy carbon spherical powder, 0.4-12 micron, type 2
Glassy carbon spherical powder, 10-20 micron, type 1
Glassy carbon spherical powder, 10-20 micron, type 2
Glassy carbon splinter powder, 0.4-12 micron, type 1
Glassy carbon splinter powder, 0.4-12 micron, type 2
Glassy carbon splinter powder, 80-200 micron, type 1
Glassy carbon splinter powder, 80-200 micron, type 2
Graphene nanoplatelets (6-8 nm thick x 5 microns wide)
Graphene Oxide Film Filtering method(size: 15cmX15cm )
Graphite powder, natural, briquetting grade, -100 mesh
Graphite powder, natural, briquetting grade, -200 mesh
Graphite powder, synthetic, conducting grade, -200 mesh
Graphite powder, synthetic, conducting grade, -325 mesh
Graphite rod, 3.8cm (1.5in) dia x 61cm (24in) long
Graphitized Carboxyl MultiWalled Carbon Nanotubes >50 nm
High concentration carboxyl MWCNTs water paste(~13wt%)
Industrial Grade Multi-walled carbon nanotubes 10-30 nm
Industrial Grade Multi-walled carbon nanotubes 12-15 nm
Monolayer Graphene on SiO2/Si(Size of SiO2: 2cmx2cm)
Nanointegris SWCNTs with small diameter Fe Catalyst 35%
Nanointegris SWCNTs with small diameter Fe Catalyst 5%
Nanointegris SWCNTs with small diameter Fe Catalyst15%
Purified Multi-walled carbon nanotubes (MWNTs) 10-20nm
Purified Multi-walled carbon nanotubes (MWNTs) 20-30nm
Purified Multi-walled carbon nanotubes (MWNTs) 30-50nm
Purified Single-walled carbon nanotubes (SWNTs) 1-2 nm
Total Organic Carbon Standard: TOC @ 100 mg/L in H2O
Trivial Transfer Graphenetrade mark 1cmx1cm(3-5 layers)
Trivial Transfer Graphenetrade mark 1cmx1cm(6-8 layers)
Trivial Transfer Graphenetrade mark 5cmx5cm(3-5 layers)
Trivial Transfer Graphenetrade mark 5cmx5cm(6-8 layers)
Carbon Nanotube Sponges (L: 1 cm, W: 1 cm, H: 1 cm)
Carbon Nanotube Sponges (L: 2 cm, W: 2 cm, H: 1 cm)
Carbon nanotubes, multi-walled, as produced cathode deposit
Carbon, rod, 100mm, diameter 1.0mm, graphite, 99.95%
Carbon, rod, 100mm, diameter 10.0mm, graphite, 100%
Carbon, rod, 100mm, diameter 13.0mm, graphite, 100%
Carbon, rod, 100mm, diameter 25mm, graphite, 99.95%
Carbon, rod, 100mm, diameter 50mm, graphite, 99.95%
Carbon, rod, 100mm, diameter 6.35mm, graphite, 100%
Carbon, rod, 150mm, diameter 10.0mm, graphite, 100%
Carbon, rod, 150mm, diameter 13.0mm, graphite, 100%
Carbon, rod, 150mm, diameter 25mm, graphite, 99.95%
Carbon, rod, 150mm, diameter 50mm, graphite, 99.95%
Carbon, rod, 150mm, diameter 6.35mm, graphite, 100%
Carbon, rod, 300mm, diameter 10.0mm, graphite, 100%
Carbon, rod, 300mm, diameter 13.0mm, graphite, 100%
Carbon, rod, 300mm, diameter 25mm, graphite, 99.95%
Carbon, rod, 300mm, diameter 6.35mm, graphite, 100%
Carbon, rod, 50mm, diameter 0.5mm, graphite, 99.95%
Carbon, rod, 50mm, diameter 1.0mm, graphite, 99.95%
Fullerene, buckytube/nanotube, single walled, > 60% SWNT
Fullerene, buckytube/nanotube, single walled, 20-35% SWNT
Funct. multi-walled carbon nanotubes (MWNTs-COOH), 95+%
Glassy carbon spherical powder, 200-400 micron, type 1
Glassy carbon spherical powder, 200-400 micron, type 2
Glassy carbon spherical powder, 400-630 micron, type 2
Glassy carbon spherical powder, 630-1000 micron, type 1
Glassy carbon spherical powder, 630-1000 micron, type 2
Graphene nanoplatelets (6-8 nm thick x 15 microns wide)
Graphene nanoplatelets (6-8 nm thick x 25 microns wide)
Graphene Oxide dispersion <500nm(C:1mg/ml solvent:water)
Graphene Oxide dispersion <500nm(C:2mg/ml solvent:water)
Graphene Oxide dispersion >500 nm(C:1mg/ml solvent:NMP)
Graphene Oxide dispersion >500 nm(C:1mg/ml solvent:water)
Graphene Oxide dispersion >500 nm(C:2mg/ml solvent:NMP)
Graphene Oxide dispersion >500 nm(C:2mg/ml solvent:water)
Graphite plate, resin impregnated, 6.35mm (0.25in) thick
Graphite rod, 1.27cm (0.5in) dia x 61cm (24in) long
Graphite rod, 2.54cm (1.0in) dia x 61cm (24in) long
Graphite rod, 6.3mm (0.25in) dia. x 61cm (24in) long
Graphitized Carboxyl Multi-Walled Carbon Nanotubes 10-20nm
Graphitized Carboxyl Multi-Walled Carbon Nanotubes 20-30nm
Graphitized Carboxyl Multi-Walled Carbon Nanotubes 8-15nm
Graphitized Carboxyl MultiWalled Carbon Nanotubes 30-50nm
Graphitized Hydroxy Multi-Walled Carbon Nanotubes 10-20nm
Graphitized Hydroxy Multi-Walled Carbon Nanotubes >50 nm
Graphitized Hydroxy Multi-Walled Carbon Nanotubes 30-50nm
Graphitized Hydroxy MultiWalled Carbon Nanotubes 20-30nm
High Purified Single-walled carbon nanotubes(SWCNTS) 1-2nm
Industrial Single-walled carbon nanotubes (SWNTs) 1-2 nm
Monolayer Graphene on SiO2/Si(Size of SiO2:1.5cmx1.5cm)
Ni Coated Multi-walled carbon nanotubes (Ni-MWNT) >50nm
Short Multi Wall Carbon Nanotubes (Short-MWNTs) 10-20nm
Short Purified Amio Single-walled Carbon Nanotubes 1-2nm
Short Single-walled carbon nanotubes (Short-SWNTs) 1-2 nm
Trivial Transfer Graphenetrade mark 1cmx1cm(10-15 layers)
Carbon - Vitreous, rod, 100mm, diameter 1.0mm, glassy carbon
Carbon - Vitreous, rod, 100mm, diameter 10mm, glassy carbon
Carbon - Vitreous, rod, 100mm, diameter 3.0mm, glassy carbon
Carbon - Vitreous, rod, 100mm, diameter 5.0mm, glassy carbon
Carbon - Vitreous, rod, 100mm, diameter 7.0mm, glassy carbon
Carbon - Vitreous, rod, 200mm, diameter 1.0mm, glassy carbon
Carbon - Vitreous, rod, 200mm, diameter 10mm, glassy carbon
Carbon - Vitreous, rod, 200mm, diameter 3.0mm, glassy carbon
Carbon - Vitreous, rod, 200mm, diameter 5.0mm, glassy carbon
Carbon - Vitreous, rod, 200mm, diameter 7.0mm, glassy carbon
Carbon - Vitreous, rod, 50mm, diameter 1.0mm, glassy carbon
Carbon - Vitreous, rod, 5mm, diameter 3.0mm, glassy carbon
Carbon Nanotube Sponges (L: 10 cm, W: 4 cm, H: 0.5 cm)
Carbon Nanotube Sponges (L: 2 cm, W: 2 cm, H: 0.5 cm)
Carbon Nanotube Sponges (L: 5 cm, W: 2 cm, H: 0.5 cm)
Carboxyl Multi wall carbon nanotubes (MWNTs-COOH) 20-30nm
Graphene Oxide dispersion <500nm(C:0.5mg/ml solvent:water)
Graphene Oxide dispersion >500 nm(C:0.5mg/ml solvent:NMP)
Graphene Oxide dispersion >500 nm(C:0.5mg/ml solvent:water)
Graphene Oxide dispersion >500 nm(C:1mg/ml solvent:ethanol )
Graphene Oxide dispersion >500 nm(C:2mg/ml solvent:ethanol )
Graphite powder, natural, microcrystal grade, APS 2-15 micron
Graphite rod, 13cm (5.125in) dia x 30.5cm (12in) long
Graphite rod, 3.05mm (0.12in) dia x 305mm (12in) long
Graphite rod, 6.15mm (0.242in) dia x 102mm (4in) long
HDPlas Functionalized Graphene Nanoplatelet(NH3 functionalized)
Highly oriented pyrolytic graphite Grade A(Size: 10x10x1.0mm)
Highly oriented pyrolytic graphite Grade A(Size:20x20x1.0 mm)
Highly oriented pyrolytic graphite Grade B(Size::5x5x1.0 mm)
Highly oriented pyrolytic graphite Grade B(Size:10x10x1.0 mm)
Highly oriented pyrolytic graphite Grade B(Size:20x20x1.0 mm)
Highly oriented pyrolytic graphite Grade C(Size:10x10x1.0 mm)
Highly oriented pyrolytic graphite Grade C(Size:5x5x1.0 mm)
Hydroxy Purified Multi-walled carbon nanotubes (MWNTs-OH) <8nm
Industrial Carboxyl Grade Multi-walled carbon nanotubes >50nm
Industrial Hydroxy Grade Multi-walled carbon nanotubes >50nm
Industrial Hydroxy Grade Multi-walled carbon nanotubes 10-30nm
Industrial Hydroxy Grade Multi-walled carbon nanotubes 20-40nm
Multi-walled carbon nanotubes (MWNTs), 95%, OD 40-60 nm
Multi-walled carbon nanotubes (MWNTs), 95+%, OD 50-80 nm
Ni Coated Multi-walled carbon nanotubes (Ni-MWNT) 10-20 nm
Ni Coated Multi-walled carbon nanotubes (Ni-MWNT) 20-30nm
Ni Coated Multi-walled carbon nanotubes (Ni-MWNT) 30-50 nm
Ni Coated Multi-walled carbon nanotubes (Ni-MWNT) 8-15 nm
Short Purified Multi-Walled Carbon Nanotubes(Short-MWNTs) <8nm
Specific Graphene for Heat Dissipation and Antistatic Plastics
-COOH Functionalized Single-walled carbon nanotubes (SWNTs-COOH)
Carbon - Vitreous, foil, 10x10mm, thickness 1.0mm, glassy carbon
Carbon - Vitreous, foil, 10x10mm, thickness 2.0mm, glassy carbon
Carbon - Vitreous, foil, 10x10mm, thickness 4.0mm, glassy carbon
Carbon - Vitreous, foil, 25x25mm, thickness 0.5mm, glassy carbon
Carbon - Vitreous, foil, 25x25mm, thickness 4.0mm, glassy carbon
Carbon - Vitreous, foil, 50x50mm, thickness 1.0mm, glassy carbon
Carbon - Vitreous, foil, 50x50mm, thickness 4.0mm, glassy carbon
Carbon - Vitreous, foil, 8mm disks, thickness 1.0mm, glassy carbon
Carbon - Vitreous, foil, 8x8mm, thickness 0.5mm, glassy carbon
Carbon, foil, 25x25mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 50x50mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 50x50mm, thickness 0.5mm, flexible graphite, 99.8%
Carbon, foil, 50x50mm, thickness 1.0mm, flexible graphite, 99.8%
Fullerene, nanotube, multi-walled, 20 nm OD, 5-20 micron long
Graphene film deposited on TEM grids(Carbon film, 5 pieces per box)
Graphene film deposited on TEM grids(Copper mesh, 5 pieces per box)
Graphene Oxide dispersion >500 nm(C:0.5mg/ml solvent:ethanol )
Graphite powder, natural, universal grade, -200 mesh, 99.9995%
Graphite, Fusion Crucible, drillpoint, unpurified, volume 7.5cc
Graphite, Fusion Crucible, drillpoint, unpurified, volume 7.88cc
HDPlas Functionalized Graphene Nanoplatelet(Argon functionalized)
HDPlas Functionalized Graphene Nanoplatelet(Carboxyl functionalized)
HDPlas Functionalized Graphene Nanoplatelet(Nitrogen functionalized)
HDPlas Functionalized Graphene Nanoplatelet(Oxygen functionalized)
Highly oriented pyrolytic graphite Grade C(Size: 20x20x1.0 mm)
Hydroxy Purified Multi-walled carbon nanotubes (MWNTs-OH) >50 nm
Hydroxy Purified Multi-walled carbon nanotubes (MWNTs-OH) 10-20nm
Hydroxy Purified Multi-walled carbon nanotubes (MWNTs-OH) 20-30nm
Hydroxy Purified Multi-walled carbon nanotubes (MWNTs-OH) 30-50nm
Hydroxy Purified Single-walled carbon nanotubes (SWNTs-OH) 1-2 nm
Industrial Carboxyl Grade Multi-walled carbon nanotubes 10-30nm
Industrial Carboxyl Grade Multi-walled carbon nanotubes 20-40 nm
PELCO 2 Layers Graphene Oxide TEM Support Films on Lacey Carbon
PELCO 6-8 layers CVD Graphene deposited on TEM Grids Lacey Carbon
Short High Purified Single-walled carbon nanotubes(SWCNTS) 1-2nm
Short Hydroxy Double-Walled Crabon Nanotubes (DWNTs-COOH) 2-4nm
Short Industrial Singlewalled carbon nanotubes (Short-SWNTs) 1-2 nm
Short Purified Multi-Walled Carbon Nanotubes (Short-MWNTs) >50 nm
Short Purified Multi-Walled Carbon Nanotubes (Short-MWNTs) 20-30nm
Short Purified Multi-Walled Carbon Nanotubes (Short-MWNTs) 8-15nm
-COOH Functionalized Multi-walled Carbon Nanotubes (MWNTs-COOH) <8nm
-COOH Functionalized multi-walled carbon nanotubes (MWNTs-COOH), 95%
2 layer Graphene deposited on TEM Grids(Carbon mesh, 5 pieces per box)
3-5 layer Graphene deposited on TEM Grids(Copper grid, 5 pieces per box)
3-5 layers Graphene deposited on TEM Grids(Carbon mesh, 5 pieces per box)
6-8 layer Graphene deposited on TEM Grids(Copper grid, 5 pieces per box)
6-8 layers Graphene deposited on TEM Grids(Carbon mesh, 5 pieces per box)
ACS Material 2 layers CVD Graphene deposited on TEM Grids Copper grid
ACS Material 2 layers CVD Graphene deposited on TEM Grids Lacey Carbon
ACS Material 3-5 layer CVD Graphene deposited on TEM Grids Copper grid
ACS Material 3-5 layers CVD Graphene deposited on TEM Grids Lacey Carbon
ACS Material 6-8 layer CVD Graphene deposited on TEM Grids Copper grid
ACS Material single layer CVD Graphene deposited on TEM Grids Copper grid
ACS Material Single layer CVD Graphene deposited on TEM Grids Lacey Carbon
ACS Material Single Layer Graphene Oxide TEM Support Films on Lacey Carbon
Bilayer Graphene on SiO2/Si(Size of SiO2:Size of SiO2: 1.5cmx1.5cm)
Carbon - Vitreous, foil, 100x100mm, thickness 1.0mm, glassy carbon
Carbon - Vitreous, foil, 100x100mm, thickness 2.0mm, glassy carbon
Carbon - Vitreous, foil, 100x100mm, thickness 6.0mm, glassy carbon
Carbon - Vitreous, foil, 10mm disks, thickness 0.2mm, glassy carbon
Carbon - Vitreous, foil, 200x200mm, thickness 1.0mm, glassy carbon
Carbon - Vitreous, foil, 25mm disks, thickness 0.2mm, glassy carbon
Carbon sputtering target, 50.8mm (2.0in) dia x 3.18mm (0.125in) thick
Carbon sputtering target, 76.2mm (3.0in) dia x 3.18mm (0.125in) thick
Carbon, foil, 100x100mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 100x100mm, thickness 0.35mm, flexible graphite, 99.8%
Carbon, foil, 100x100mm, thickness 0.5mm, flexible graphite, 99.8%
Carbon, foil, 100x100mm, thickness 1.0mm, flexible graphite, 99.8%
Carbon, foil, 10mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 150x150mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 150x150mm, thickness 0.35mm, flexible graphite, 99.8%
Carbon, foil, 150x150mm, thickness 0.5mm, flexible graphite, 99.8%
Carbon, foil, 150x150mm, thickness 1.0mm, flexible graphite, 99.8%
Carbon, foil, 15mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 250x250mm, thickness 0.35mm, flexible graphite, 99.8%
Carbon, foil, 250x250mm, thickness 0.5mm, flexible graphite, 99.8%
Carbon, foil, 250x250mm, thickness 1.0mm, flexible graphite, 99.8%
Carbon, foil, 25mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 25x25mm, thickness 0.1mm, pyrolytic graphite, 99.99%
Carbon, foil, 25x25mm, thickness 0.5mm, pyrolytic graphite, 99.99%
Carbon, foil, 300x300mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 4mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 500x500mm, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 500x500mm, thickness 0.35mm, flexible graphite, 99.8%
Carbon, foil, 500x500mm, thickness 0.5mm, flexible graphite, 99.8%
Carbon, foil, 500x500mm, thickness 1.0mm, flexible graphite, 99.8%
Carbon, foil, 50mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 50x50mm, thickness 0.1mm, pyrolytic graphite, 99.99%
Carbon, foil, 50x50mm, thickness 0.2mm, pyrolytic graphite, 99.99%
Carbon, foil, 50x50mm, thickness 0.35mm, flexible graphite, 99.8%
Carbon, foil, 6mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carbon, foil, 8mm disks, thickness 0.2mm, flexible graphite, 99.8%
Carboxyl Purified Multi-walled carbon nanotubes (MWNTs-COOH) >50 nm
Carboxyl Purified Multi-walled carbon nanotubes (MWNTs-COOH) 10-20nm
Carboxyl Purified Single-walled carbon nanotubes (SWNTs-COOH) 1-2 nm
Graphene oxide dispersion Diameter 50-200nm(C:0.5mg/ml solvent:water)
Graphene oxide dispersion Diameter 50-200nm(C:1mg/ml solvent:water)
Graphene oxide dispersion Diameter 50-200nm(C:2mg/ml solvent:water)
Graphite electrode, counter-pointed tip, 3.06mm dia, 38.10 mm long
Graphite electrode, counter-spherical tip, 6.15mm dia, 38.10 mm long
Graphite plate, pyrolytic, 1.27x9.98x9.98mm (0.05x0.393x.393in)
Graphite powder, microcrystalline, -300 mesh, 75-82% C, 18-25% Ash
Graphite rod, pyrolytic coated, 2mm (0.08in) dia x 152mm (6in) long
HDPlas Functionalized Graphene Nanoplatelet(Fluorocarbon functionalized)
High Purified Hydroxylate Single-walled carbon nanotubes (SWCNTS-OH) 1-2nm
High Purified Large Surface Area Single-walled Carbon nanotubes 1-2nm
Highly oriented pyrolytic graphite Grade A(Size: 20x20x(1.6~2.0)mm)
Highly oriented pyrolytic graphite Grade B(Size :20x20x(1.6-2.0) mm)
Highly oriented pyrolytic graphite Grade B(Size:30x30x(1.6-2.0)mm)
Highly oriented pyrolytic graphite Grade C(Size: 20x20x(1.6-2.0)mm)
Highly oriented pyrolytic graphite Grade C(Size: 30x30x(1.6-2.0)mm)
Industrial Carboxyl Single-Walled Crabon Nanotubes (SWNTS-COOH) 1-2 nm
Industrial Hydroxy Single-walled Carbon Nanotubes (SWNTs-OH) 1-2 nm
Methane, compressed or natural gas, compressed (with high methane content)
Multi-walled carbon nanotubes (MWNTs), 95%, Outside diameter 10-20 nm
Multi-walled carbon nanotubes (MWNTs), 95%, Outside diameter 20-30 nm
Short Carboxyl single-walled CrabonNanotubes (Short-SWNTS-COOH) 1-2 nm
Short Hydroxy Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-OH) <8nm
Short Hydroxy single-walled Crabon Nanotubes (Short-SWNTs-OH) 1-2 nm
Single layer Graphene deposited on TEM Grids(Carbon mesh, 5 pieces per box)
Single layer Graphene deposited on TEM Grids(Copper grid, 5 pieces per box)
2 layers Graphene deposited on TEM Grids Cu grid(Copper grid, 5 pieces per box)
Carbon - Vitreous, foam, 150x150mm, 0.05g.cmu??, porosity 96.5%, 24 pores/cm
Carbon - Vitreous, foam, 275x330mm, 0.05g.cmu??, porosity 96.5%, 24 pores/cm
Carbon nanotube array, multi-walled, on quartz (diameter= 100nm, length=30 microns)
Carbon nanotube array, multi-walled, vertically aligned on copper wafer substrate
Carbon nanotube array, multi-walled, vertically aligned on silicon wafer substrate
Carbon nanotubes, multi-walled (diameter= 140nm, length= 7microns)(>90%nanotubes)
Carbon, chopped fiber, 100g, nominal diameter 0.007mm, fiber length 6mm, grade 34-700
Carbon, chopped fiber, 200g, nominal diameter 0.007mm, fiber length 1mm, grade 34-700
Carbon, chopped fiber, 200g, nominal diameter 0.007mm, fiber length 6mm, grade 34-700
Carbon, foil, 100x100mm, thickness 0.125mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 100x100mm, thickness 0.25mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 100x100mm, thickness 0.25mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 100x100mm, thickness 0.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 100x100mm, thickness 0.5mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 100x100mm, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 100x100mm, thickness 10.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, 100x100mm, thickness 2.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 100x100mm, thickness 5.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, 12.5x12.5mm, thickness 0.125mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 12mm disks, thickness 0.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 12mm disks, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 150x150mm, thickness 0.125mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 150x150mm, thickness 0.25mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 150x150mm, thickness 0.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 150x150mm, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 150x150mm, thickness 10.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, 150x150mm, thickness 5.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, 200x200mm, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 0.125mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 0.15mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 0.25mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 0.25mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 25x25mm, thickness 0.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 0.5mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 25x25mm, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 25x25mm, thickness 2.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 48x48mm, thickness 10.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, 50x50mm, thickness 0.125mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 50x50mm, thickness 0.25mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 50x50mm, thickness 0.25mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 50x50mm, thickness 0.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 50x50mm, thickness 0.5mm, rigid graphite, fine grain size, 99.997%
Carbon, foil, 50x50mm, thickness 1.0mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 50x50mm, thickness 2.5mm, rigid graphite, fine grain size, 99.95%
Carbon, foil, 50x50mm, thickness 5.0mm, rigid graphite, medium grain size, 99.5%
Carbon, foil, not light tested, 100x100mm, thickness 0.075mm, flexible graphite, 99.8%
Carbon, foil, not light tested, 150x150mm, thickness 0.075mm, flexible graphite, 99.8%
Carbon, foil, not light tested, 150x150mm, thickness 0.125mm, flexible graphite, 99.8%
Carbon, foil, not light tested, 300x300mm, thickness 0.075mm, flexible graphite, 99.8%
Carbon, foil, not light tested, 300x300mm, thickness 0.125mm, flexible graphite, 99.8%
Carbon, mesoporous, nanopowder, <500 nm particle size (DLS), >99.95% trace metals basis
Carbon, microleaf, 24x70mm, thinness 5.0mum, specific density 1000mug/cm2, 99.997%
Carbon, microleaf, 25x70mm, thinness 1.25mum, specific density 250mug/cm2, 99.997%
Carbon, microleaf, 25x70mm, thinness 2.5mum, specific density 500mug/cm2, 99.997%
Carbon, microleaf, 50x70mm, thinness 1.25mum, specific density 250mug/cm2, 99.997%
Carbon, microleaf, 50x70mm, thinness 2.5mum, specific density 500mug/cm2, 99.997%
Charcoal briquettes, shell, screenings, wood, etc. [NA1361] [Spontaneously combustible]
Fullerene, nanotube, multi-walled, as-produced cathode deposits, core and shell
Graphene powder (1-5 layers thick x 0.5-5 microns wide, surface area 650-750 m2/g)
High Purified Carboxylic Single-walled carbon nanotubes (SWCNTS-COOH) 1-2nm
PELCO 2 Layers Graphene Oxide TEM Support Films on(Carbon mesh, 5 pieces per box)
PELCO Single Layer Graphene Oxide TEM Support Film(Carbon mesh, 5 pieces per box)
Short Carboxyl Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-COOH) <8nm
Short Carboxyl Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-COOH) 10-20nm
Short Carboxyl Purified Multi-Walled Carbon Nanotubes(Short-MWNTs-COOH) >50 nm
Short Carboxyl Purified Multi-Walled Carbon Nanotubes(Short-MWNTs-COOH) 20-30nm
Short Carboxyl Purified Multi-Walled Carbon Nanotubes(Short-MWNTs-COOH) 30-50nm
Short Carboxyl Purified Multi-Walled Carbon Nanotubes(Short-MWNTs-COOH) 8-15nm
Short High Purified Carboxylic Single-walled Carbon Nanotubes(SWCNTS-COOH) 1-2nm
Short High Purified Hydroxylate Single-walled Carbon Nanotubes(SWCNTS-OH) 1-2nm
Short Hydroxy Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-OH) >50 nm
Short Hydroxy Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-OH) 20-30nm
Short Hydroxy Purified Multi-Walled Carbon Nanotubes (Short-MWNTs-OH) 8-15nm
Total Organic Carbon (TOC), standard solution, Specpure?, 1000 microgram/ml
Carbon - Vitreous, foam, 150x150mm, thickness 2.5mm, bulk density 0.05g/cm3, porosity 96.5%
Carbon - Vitreous, foam, 150x150mm, thickness 3.2mm, bulk density 0.05g/cm3, porosity 96.5%
Carbon - Vitreous, foam, 275x330mm, thickness 3.2mm, bulk density 0.05g/cm3, porosity 96.5%
Carbon - Vitreous, foam, 300x300mm, thickness 20mm, bulk density 0.05g/cm3, porosity 96.5%
Carbon - Vitreous, foam, 300x300mm, thickness 30mm, bulk density 0.05g/cm3, porosity 96.5%
Carbon - Vitreous, tube, 100mm, outside diameter 10mm, inside diameter 3mm, wall thickness 3.5mm, glassy carbon
Carbon - Vitreous, tube, 50mm, outside diameter 10mm, inside diameter 3mm, wall thickness 3.5mm, glassy carbon
Carbon nanofibers, graphitized (iron-free), composed of conical platelets, D x L 100 nm x 20-200 mum
Carbon nanofibers, graphitized, platelets (conical), >98% carbon basis, D x L 100 nm x 20-200 mum
Carbon nanofibers, pyrolitically stripped, platelets (conical), >98% carbon basis, D x L 100 nm x 20-200 mum
Carbon nanotubes, multi-walled, arc-produced (diameter = 2-50nm, length = >2 microns) (55-65Wt% nanotubes)
Carbon, fabric coil, 0.5m, weight.mu?? 110g, thickness 0.5mm, ends x picks/10cm 130x130, plain weave
Carbon, fabric coil, 1m, weight.mu?? 110g, thickness 0.5mm, ends x picks/10cm 130x130, plain weave
Carbon, fabric, 1000x1000mm, weight.mu?? 375g, thickness 0.4mm, ends x picks/10cm 47x47, 2/2 twill weave
Carbon, fabric, 1000x1000mm, weight.mu?? 92g, thickness 0.15mm, ends x picks/10cm 69x69, plain weave
Carbon, fabric, 150x150mm, weight.mu?? 200g, thickness 0.3mm, ends x picks/10cm 50x50, plain weave
Carbon, fabric, 150x150mm, weight.mu?? 375g, thickness 0.4mm, ends x picks/10cm 47x47, 2/2 twill weave
Carbon, fabric, 250x250mm, weight.mu?? 92g, thickness 0.15mm, ends x picks/10cm 69x69, plain weave
Carbon, fabric, 300x300mm, weight.mu?? 110g, thickness 0.5mm, ends x picks/10cm 130x130, plain weave
Carbon, fabric, 500x500mm, weight.mu?? 375g, thickness 0.4mm, ends x picks/10cm 47x47, 2/2 twill weave
Carbon, fabric, 500x500mm, weight.mu?? 92g, thickness 0.15mm, ends x picks/10cm 69x69, plain weave
Carbon, fiber, 1000m, tex number 200, filament diameter 0.007mm, number of filaments 3000, grade tenax hta, epoxy sized
Carbon, fiber, 1000m, tex number 720, filament diameter 0.011mm, number of filaments 4000, grade p25, epoxy sized
Carbon, fiber, 1000m, tex number 795, filament diameter 0.007mm, number of filaments 12000, grade XaS, epoxy sized (1.6%)
Carbon, fiber, 100m, tex number 280, filament diameter 0.009mm, number of filaments 2000, grade f500, epoxy sized (1.0%)
Carbon, fiber, 100m, tex number 400, filament diameter 0.007mm, number of filaments 6000, grade tenax hta, epoxy sized (1.2%)
Carbon, fiber, 100m, tex number 400, number of filaments 12000, continuous multi-filament TOW.
Carbon, fiber, 10m, tex number 200, filament diameter 0.007mm, number of filaments 3000, grade tenax hta, epoxy sized
Carbon, fiber, 10m, tex number 400, filament diameter 0.007mm, number of filaments 6000, grade tenax hta, epoxy sized (1.2%)
Carbon, fiber, 10m, tex number 900, filament diameter 0.008mm, number of filaments 10000, grade hm, epoxy sized (0.7%)
Carbon, fiber, 200m, tex number 280, filament diameter 0.009mm, number of filaments 2000, grade f500, epoxy sized (1.0%)
Carbon, fiber, 200m, tex number 795, filament diameter 0.007mm, number of filaments 12000, grade XaS, epoxy sized (1.6%)
Carbon, fiber, 20m, tex number 400, number of filaments 12000, continuous multi-filament TOW.
Carbon, fiber, 20m, tex number 420, filament diameter 0.01mm, number of filaments 3000, grade f180, epoxy sized (1.0%)
Carbon, fiber, 20m, tex number 900, filament diameter 0.008mm, number of filaments 10000, grade hm, epoxy sized (0.7%)
Carbon, fiber, 500m, tex number 200, filament diameter 0.007mm, number of filaments 3000, grade tenax hta, epoxy sized
Carbon, fiber, 50m, tex number 280, filament diameter 0.009mm, number of filaments 2000, grade f500, epoxy sized (1.0%)
Carbon, fiber, 50m, tex number 400, filament diameter 0.007mm, number of filaments 6000, grade tenax hta, epoxy sized (1.2%)
Carbon, fiber, 50m, tex number 400, number of filaments 12000, continuous multi-filament TOW.
Carbon, fiber, 50m, tex number 795, filament diameter 0.007mm, number of filaments 12000, grade XaS, epoxy sized (1.6%)
Carbon, mesoporous, average pore diameter 100 ??+/-10 ?? (typical), >99.95% trace metals basis
Carbon, mesoporous, nanopowder, graphitized, <500 nm particle size (DLS), >99.95% trace metals basis
Carbon, microleaf, 25x70mm, thinness 0.0025mum, specific density 0.5mug/cm2, temporary glass support, 99.997%
Carbon, microleaf, 25x70mm, thinness 0.025mum, specific density 5mug/cm2, temporary glass support, 99.997%
Carbon, microleaf, 25x70mm, thinness 0.050mum, specific density 10mug/cm2, temporary glass support, 99.997%
Carbon, microleaf, 25x70mm, thinness 0.25mum, specific density 50mug/cm2, temporary glass support, 99.997%
Carbon, microleaf, 25x70mm, thinness 0.50mum, specific density 100mug/cm2, temporary glass support, 99.997%
Carbon, microleaf, 25x70mm, thinness 0.50mum, specific density 100mug/cm2, temporary glass support, annealed, 99.997%
Carbon, tube, graphite, 100mm, outside diameter 12.7mm, inside diameter 9.5mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 100mm, outside diameter 3.18mm, inside diameter 1.18mm, wall thickness 1.0mm, 99.95%
Carbon, tube, graphite, 100mm, outside diameter 6.35mm, inside diameter 3.15mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 150mm, outside diameter 12.7mm, inside diameter 9.5mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 150mm, outside diameter 3.18mm, inside diameter 1.18mm, wall thickness 1.0mm, 99.95%
Carbon, tube, graphite, 150mm, outside diameter 6.35mm, inside diameter 3.15mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 47mm, outside diameter 6.35mm, inside diameter 3.15mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 50mm, outside diameter 12.7mm, inside diameter 9.5mm, wall thickness 1.6mm, 99.95%
Carbon, tube, graphite, 50mm, outside diameter 3.18mm, inside diameter 1.18mm, wall thickness 1.0mm, 99.95%
Graphite electrode, crater-drillpoint/undercut, 4.57mm dia, 38.10mm length, volume 0.040cc
Graphite fusion crucible lid for stock number 40794, 2.54cm (1.0in) dia, 6.35mm (0.25in) thick
Graphite plate, highly oriented pyrolytic graphite (HOPG), 10x10x(1.6min)mm (0.394x0.394x0.079in), 0.4 +0.1 o mosaic angle
Graphite plate, highly oriented pyrolytic graphite (HOPG), 10x10x(1.6min)mm (0.394x0.394x0.079in), 0.8 +0.2 o mosaic angle
Graphite plate, highly oriented pyrolytic graphite (HOPG), 10x10x1mm (0.394x0.394x0.039in), 0.4 +0.1 o mosaic angle
Graphite plate, highly oriented pyrolytic graphite (HOPG), 10x10x1mm (0.394x0.394x0.039in), 0.8 +0.2 o mosaic angle
MeH
Methane, compressed or natural gas, compressed (with high methane content) [UN1971] [Flammable gas]
Methane, refrigerated liquid (cryogenic liquid) or natural gas, refrigerated liquid (cryogenic liquid) (with high methane content)
Methane, refrigerated liquid (cryogenic liquid) or natural gas, refrigerated liquid (cryogenic liquid) (with high methane content) [UN1972] [Flammable gas]
OH functionalized Single-walled carbon nanotubes (SWNTs-OH), Purity (excluding -OH): 90% CNTs, 60% SWNTs, Content of -OH: 3.76-4.16 wt%
OH functionalized Single-walled carbon nanotubes (SWNTs-OH), Purity (excluding -OH): 95% CNTs, 90% SWNTs, Content of ?OH: 3.76-4.16 wt%
Microorganism:

Yes

IUPAC namemethane
SMILESC
InchiInChI=1S/CH4/h1H4
FormulaCH4
PubChem ID297
Molweight16.043
LogP0.6
Atoms1
Bonds0
H-bond Acceptor0
H-bond Donor0
Chemical Classificationalkanes aliphatics unsaturated hydrocarbons aliphatic compounds
CHEBI-ID16183
Supernatural-IDSN0395377

mVOC Specific Details

Boiling Point
DegreeReference
161.5 °C peer reviewed
Volatilization
The Henry's Law constant for methane is estimated as 0.66 atm-cu m/mole(SRC) derived from its vapor pressure, 4.66X10+5 mm Hg(1), and water solubility, 22 mg/L(2). This Henry's Law constant indicates that methane is expected to volatilize rapidly from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 2 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 2 hours(SRC). Methane's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of methane from dry soil surfaces may exist(SRC) based upon the vapor pressure(1).
Soil Adsorption
The Koc of methane is estimated as 9(SRC), using a log Kow of 1.09(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that methane is expected to have very high mobility in soil. Methane's vapor pressure of 4.7X10+5 mm Hg(4) suggests that this compound will permeate through soil(SRC).
Massbank-Links

Species emitting the compound
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno


Ethane-1,2-diol

Compound Details

Synonymous names
ETHYLENE GLYCOL
Ethane-1,2-diol
1,2-ethanediol
107-21-1
glycol
monoethylene glycol
1,2-Dihydroxyethane
2-hydroxyethanol
Glycol alcohol
Ethylene alcohol
Macrogol
Fridex
Tescol
Ethylene dihydrate
Norkool
Macrogol 400 BPC
Dowtherm SR 1
Zerex
Ucar 17
Lutrol-9
ethanediol
ethyleneglycol
Aethylenglykol
Glycol, ethylene-
1,2-Ethandiol
1,2-ethylene glycol
Caswell No. 441
146AR
NSC 93876
Athylenglykol
CCRIS 3744
ethylen glycol
DTXSID8020597
HSDB 5012
M.e.g.
NCI-C00920
UNII-FC72KVT52F
EINECS 203-473-3
FC72KVT52F
Lutrol 9
MFCD00002885
EPA Pesticide Chemical Code 042203
NANOSILVER+EG
PEG
CHEBI:30742
AI3-03050
HOCH2CH2OH
NSC-93876
LOWENOL T-163A
DTXCID40597
37225-26-6
EC 203-473-3
ETHYLENE GLYCOL (II)
ETHYLENE GLYCOL [II]
ETHYLENE GLYCOL (MART.)
ETHYLENE GLYCOL [MART.]
Ethylenglycol
Aethylenglykol [German]
ethylene-glycol
2 Hydroxyethanol
Glycol, Ethylene
PEG 1000
CAS-107-21-1
GLYCEROL IMPURITY B (EP IMPURITY)
GLYCEROL IMPURITY B [EP IMPURITY]
Macrogol 400
Glycol, Monoethylene
Dowtherm 4000
1,2-dihydroxy ethane
WLN: Q2Q
ethyleneglycole
ehtylene glycol
etylene glycol
2-ethanediol
Ilexan E
4-vinyl cathecol
MEG 100
Solbanon (TN)
1,2-ethane diol
1,2-ethane-diol
ethane-1.2-diol
GXT
Hydroxyethyl Salicylate Imp. B (EP); Ethylene Glycol; Propan-1,2-diol; Glycerol Impurity B; Hydroxyethyl Salicylate Impurity B
1,2-ethyleneglycol
ethan-1,2-diol
mono-ethylene glycol
Ethane-1,2-diol (Ethylene Glycol)
Mono Ethylene Glycol
1,2-ethylene-glycol
Lutrol E (TN)
YLENE GLYCOL
1,2-Ethylene Glycol (Ethylene Glycol)
Kollisolv PEG 300
DuPont Zonyl FSO Fluorinated Surfactants
Ethylene glycol, aerosol
GLYCOL [INCI]
Macrogol 400 (TN)
Ethylene glycol 1000 microg/mL in Methanol
Ethyleneglycol, ReagentPlus
Macrogol 1500 (TN)
Macrogol 4000 (TN)
Macrogol 6000 (TN)
Macrogol ointment (JP17)
HO-CH2-CH2-OH
HO(CH2)2OH
NCIOpen2_001979
NCIOpen2_002019
NCIOpen2_002100
Macrogol 400 (JP17)
ETHYLENE GLYCOL [MI]
MLS002454404
BIDD:ER0283
Macrogol 1500 (JP17)
Macrogol 4000 (JP17)
Macrogol 6000 (JP17)
Poly(ethylene Glycol) ~200
Poly(ethylene Glycol) ~400
Poly(ethylene Glycol) ~600
ETHYLENE GLYCOL [HSDB]
CHEMBL457299
Poly(ethylene Glycol) ~1000
Poly(ethylene Glycol) ~2000
Poly(ethylene Glycol) ~4000
Poly(ethylene Glycol) ~6000
Poly(ethylene Glycol) ~9000
Ethylene glycol, AR, >=99%
Ethylene glycol, LR, >=99%
Macrogol 20000 (JP17)
CHEBI:46793
ETHYLENE GLYCOL [USP-RS]
ETHYLENE GLYCOL [WHO-DD]
PEG1000
Poly(ethylene Glycol) ~20000
HMS2267F07
Ethylene glycol, p.a., 99.5%
Poly(ethylene Glycol) ~30,000
Poly(ethylene Glycol) ~40,000
1,2-ETHANEDIOL (GLYCOL)
AMY22336
Ethylene Glycol Blank Standard in Multi-grade Diesel Engine Oil
NSC32853
NSC32854
NSC57859
NSC93876
PEG 3600
PEG-1000
STR01171
Ethylene glycol, analytical standard
Tox21_202038
Tox21_300637
Ethylene glycol, anhydrous, 99.8%
NSC-32853
NSC-32854
NSC-57859
NSC152324
NSC152325
NSC155081
STL264188
100 microg/g Ethylene Glycol Standard in Multi-grade Diesel Engine Oil
1000 microg/g Ethylene Glycol Standard in Multi-grade Diesel Engine Oil
2000 microg/g Ethylene Glycol Standard in Multi-grade Diesel Engine Oil
500 microg/g Ethylene Glycol Standard in Multi-grade Diesel Engine Oil
AKOS000119039
MCULE-6366313128
NSC-152324
NSC-152325
NSC-155081
USEPA/OPP Pesticide Code: 042203
NCGC00091510-01
NCGC00091510-02
NCGC00091510-03
NCGC00254292-01
NCGC00259587-01
BP-13454
BP-31056
SMR001262244
Ethylene glycol, ReagentPlus(R), >=99%
>99% (GC)
DuPont Zonyl FSE Fluorinated Surfactants
Residual Solvent Class 2 - Ethylene Glycol
E0105
Ethylene glycol, puriss., >=99.5% (GC)
NS00003552
1,2-Ethane-1,1,2,2-d4-diol-d2(9ci)
EN300-19312
Ethylene glycol, BioUltra, >=99.5% (GC)
Ethylene glycol, SAJ first grade, >=99.0%
C01380
D03370
D06418
D06419
D06420
D06421
D06422
D06423
Ethylene glycol, JIS special grade, >=99.5%
Ethylene glycol, anhydrous, ZerO2(TM), 99.8%
Ethylene glycol, Vetec(TM) reagent grade, 98%
A851234
Ethylene glycol, spectrophotometric grade, >=99%
Q194207
InChI=1/C2H6O2/c3-1-2-4/h3-4H,1-2H
J-001731
F0001-0142
004143F9-240E-472F-9D5A-B1B13BBA2A18
Ethylene glycol, United States Pharmacopeia (USP) Reference Standard
600 microg/g Ethylene Glycol QC Check Standard in Multi-grade Diesel Engine Oil
Ethylene glycol, Pharmaceutical Secondary Standard; Certified Reference Material
ethylene glycol;1,2-ethanediol;ethane-1,2-diol;glycolethylene glycol;ethanediol;ethylene glycol 1,2-ethanediol ethane-1,2-diol glycolethylene glycol ethanediol
Residual Solvent Class 2 - Ethylene Glycol, United States Pharmacopeia (USP) Reference Standard
Microorganism:

Yes

IUPAC nameethane-1,2-diol
SMILESC(CO)O
InchiInChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
FormulaC2H6O2
PubChem ID174
Molweight62.07
LogP-1.4
Atoms4
Bonds1
H-bond Acceptor2
H-bond Donor2
Chemical Classificationalcohols glycols diols
CHEBI-ID30742
Supernatural-IDSN0218564

mVOC Specific Details

Boiling Point
DegreeReference
197.3 °C peer reviewed
Volatilization
The Henry's Law constant for ethylene glycol is 6.00X10-8 atm-cu m/mole(1). This Henry's Law constant indicates that ethylene glycol is expected to be essentially nonvolatile from water surfaces(2). Ethylene glycol's Henry's Law constant indicates that volatilization from moist soil surfaces is not expected(SRC). Ethylene glycol is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.0878 mm Hg at 25 °C(3).
Soil Adsorption
The Koc of ethylene glycol is estimated as 0.2(SRC), using a log Kow of -1.36(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that ethylene glycol is expected to have very high mobility in soil(SRC). Percent adsorption to 4 soils (two clay and two sandy clay soils) ranged from 0-0.5% indicating that this compound is not readily adsorbed to these soils and should have high mobility(4). Desorption was almost complete at the end of a 4 hour experiment using the same soils and a montmorillonite sample(4). Leaching experiments with undisturbed soil cores of sandy till showed that 14C-labelled ethylene glycol closely followed the movement of water when chloride was used as a tracer; no adsorption was observed for this compound onto subhorizons of sandy till, clayey till, and melt water sand(5).
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANAZhu et al. 2010
ProkaryotaStaphylococcus AureusNANAZhu et al. 2010
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaTSBSESI-MSno
ProkaryotaStaphylococcus AureusTSBSESI-MSno


Methanethiol

Mass-Spectra

Compound Details

Synonymous names
methanethiol
METHYL MERCAPTAN
Methylmercaptan
Mercaptomethane
74-93-1
Methyl sulfhydrate
Thiomethanol
Methanthiol
Thiomethyl alcohol
Metilmercaptano
Methvtiolo
Methylmercaptaan
Mercaptan methylique
Methaanthiol
Thiomethane
RCRA waste number U153
FEMA No. 2716
Methanethiole
CH3SH
methyl-mercaptan
Methyl thioalcohol
MeSH
UN 1064
2X8406WW9I
Methaanthiol [Dutch]
Methanthiol [German]
Methvtiolo [Italian]
Methylmercaptaan [Dutch]
Metilmercaptano [Italian]
Metilmercaptano [Spanish]
SCH 54292
Methyl mercaptan (natural)
Mercaptan methylique [French]
HSDB 813
EINECS 200-822-1
UN1064
RCRA waste no. U153
BRN 1696840
methylsulfanyl
methane thiol
methyl sulfides
methyl thiol
methyl-thiol
UNII-2X8406WW9I
(methyl)sulfane
Methylthioalcohol
a methyl thioether
sulfonium methylide
Methanethiol, purum
Methanethiol, 98.0%
METHANETHIOL [MI]
EC 200-822-1
Methanethiol, >=98.0%
4-01-00-01273 (Beilstein Handbook Reference)
METHYL MERCAPTAN [FHFI]
METHYL MERCAPTAN [HSDB]
DTXSID5026382
CHEBI:16007
CHEBI:86315
DTXSID10168842
DTXSID60992376
InChI=1/CH4S/c1-2/h2H,1H
NSC229573
AKOS009157032
NSC-229573
Methyl mercaptan [UN1064] [Poison gas]
NS00020025
C00409
Q409309
17719-48-1
Z22
Microorganism:

Yes

IUPAC namemethanethiol
SMILESCS
InchiInChI=1S/CH4S/c1-2/h2H,1H3
FormulaCH4S
PubChem ID878
Molweight48.11
LogP0.5
Atoms2
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationsulfur compounds thiols
CHEBI-ID16007
Supernatural-IDSN0213930

mVOC Specific Details

Boiling Point
DegreeReference
5.95 °C peer reviewed
Volatilization
The Henry's Law constant for methyl mercaptan is estimated as 0.0031 atm-cu m/mole(SRC) derived from its vapor pressure, 1,510 mm Hg(1), and water solubility, 15,400 mg/L(2). This Henry's Law constant indicates that methyl mercaptan is expected to volatilize rapidly from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 0.8 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 2.8 days(SRC). Methyl mercaptan's Henry's Law constant indicates that volatilization from moist soil surfaces is expected to occur(SRC). Methyl mercaptan is expected to volatilize rapidly from dry soil surfaces based upon its vapor pressure and because it is a gas a temperatures above 6 deg C(SRC). However, gaseous methyl mercaptan gas has been found to strongly adsorb to moist and dry soil surfaces suggesting that adsorption might be an environmental sink for methyl mercaptan(4). Therefore, the importance of volatilization from soil surfaces may be attenuated by adsorption(SRC).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1989) (2) Hine J, Mookerjee PK; J Org Chem 40: 292-8 (1975) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (4) Smith KA et al; Soil Sci 116: 313-9 (1973)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of methyl mercaptan can be estimated to be 13(SRC). According to a classification scheme(2), this estimated Koc value suggests that methyl mercaptan is expected to have very high mobility in soil. Gaseous methyl mercaptan has been observed to partition to soils(3). For example, when gaseous methyl mercaptan was passed over six air-dried and moist (50% field capacity) soils, 2.4-32.1 mg/g and 2.2-21.4 mg/g of methyl mercaptan rapidly adsorbed to the dry and moist soils, respectively(3). Neither the capacity or rate of sorption was correlated to soil pH, organic matter content, or clay content; sterile controls ruled out the involvement of microorganisms(3); it was suggested that adsorption to soil surfaces might be an environmental sink for gaseous methyl mercaptan(3).
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Jan, 2011. Available from, as of July 19, 2012: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Swann RL et al; Res Rev 85: 17-28 (1983) (3) Smith KA et al; Soil Sci 116: 313-9 (1973)
Vapor Pressure
PressureReference
1,510 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
MS-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAChippendale et al. 2014
ProkaryotaEscherichia ColiNANADolch et al. 2012
ProkaryotaPseudomonas AeruginosaNANADolch et al. 2012
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEnterococcus FaecalisNANAThorn et al. 2011
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAScotter et al. 2006
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaNeisseria MeningitidisNANAScotter et al. 2006
ProkaryotaProteus MirabilisNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANACarroll et al. 2005
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAThorn et al. 2011
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaStreptococcus PneumoniaeNANAScotter et al. 2006
ProkaryotaStreptococcus PyogenesNANAThorn et al. 2011
ProkaryotaHaemophilus InfluenzaeNANAFilipiak et al. 2012
ProkaryotaPseudomonas AeruginosaNANANA
ProkaryotaPseudomonas AeruginosaNANAFilipiak et al. 2012
ProkaryotaStaphylococcus AureusNANAFilipiak et al. 2012
ProkaryotaStreptococcus PneumoniaeNANAFilipiak et al. 2012
ProkaryotaKlebsiella PneumoniaeNARees et al. 2017
EukaryotaFusarium OxysporumonionWang et al. 2018
EukaryotaFusarium ProliferatumonionWang et al. 2018
ProkaryotaPseudomonas Fluorescens0Medicago spp. plant rhizospheresHernández-León et al. 2015
ProkaryotaPseudomonas Sp.antifungal activity against Thielaviopsis ethacetica mycelial growthBrazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; BrazilFreitas et al. 2022
ProkaryotaPaenibacillus PolymyxaNAMülner et al. 2021
EukaryotaCandida AlbicansATCC MYA-2876, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida GlabrataATCC 90030, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida TropicalisATCC 750, American Type Culture CollectionCosta et al. 2020
ProkaryotaBacillus AtrophaeusLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus AmyloliquefaciensLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus LicheniformisLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus PumilusLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
EukaryotaTuber Magnatumcollected from natural truffle orchards in Istria (Croatia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Baranya (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Somogy (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Abruzzo (Italy) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Kalubara (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Srem (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
ProkaryotaBacillus Amyloliquefaciensn/aNALee et al. 2012
ProkaryotaBacillus Subtilisn/aNALee et al. 2012
ProkaryotaPaenibacillus Polymyxan/aNALee et al. 2012
ProkaryotaAlpha Proteobacterian/aNASchulz and Dickschat 2007
ProkaryotaGamma Proteobacterian/aNASchulz and Dickschat 2007
ProkaryotaAlcaligenes Faecalisn/aNASchulz and Dickschat 2007
ProkaryotaDesulfovibrio Acrylicusn/aNASchulz and Dickschat 2007
ProkaryotaParasporobacterium Paucivoransn/aNASchulz and Dickschat 2007
ProkaryotaLactococcus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Lactisn/aNASchulz and Dickschat 2007
ProkaryotaBrevibacterium Linensn/aNASchulz and Dickschat 2007
ProkaryotaOenococcus Oenin/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Brevisn/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Hilgardiin/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Plantarumn/aNASchulz and Dickschat 2007
ProkaryotaPorphyromonas Gingivalisn/aNASchulz and Dickschat 2007
ProkaryotaFusobacterium Nucleatumn/aNASchulz and Dickschat 2007
ProkaryotaTreponema Denticolan/aNASchulz and Dickschat 2007
ProkaryotaCitrobacter Freundiin/aNASchulz and Dickschat 2007
ProkaryotaEscherichia Colin/aNABunge et al. 2008
ProkaryotaShigella Flexnerin/aNABunge et al. 2008
ProkaryotaSalmonella Enterican/aNABunge et al. 2008
EukaryotaCandida Tropicalisn/aNABunge et al. 2008
EukaryotaTuber Magnatumn/aItalian geographical areas (Piedmont, Marche, Emilia Romagna, Border region area between Emilia Romagna and Marche)Gioacchini et al. 2008
ProkaryotaPseudomonas PutidananaSchöller et al. 1997
ProkaryotaPseudomonas TolaasiinanaLo Cantore et al. 2015
ProkaryotaPseudomonas Putidanarhizosphere of bean plants, southern ItalyGiorgio et al. 2015
ProkaryotaRalstonia SolanacearumnanaSpraker et al. 2014
ProkaryotaKlebsiella PneumoniaeNARees et al. 2016a
EukaryotaSchizophyllum Communen/aNAStotzky and Schenck 1976
ProkaryotaStreptococcus PneumoniaeclinicPreti et al. 2009
ProkaryotaPseudomonas Perolensnasterile fish muscle (Sebastes melanops)Miller et al. 1973
ProkaryotaAchromobacter Sp.NANAAlmeida et al. 2022
ProkaryotaSerratia Sp.NANAAlmeida et al. 2022
ProkaryotaEnterobacter Sp.NANAAlmeida et al. 2022
ProkaryotaEscherichia ColiNANAAlmeida et al. 2022
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPsychrobacillus VulpisNANAToral et al. 2021
MicrobacteriumBallot et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusBHIGC-MSno
ProkaryotaEscherichia ColiLBIMR-MSno
ProkaryotaPseudomonas AeruginosaLBIMR-MSno
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaEnterococcus FaecalisTYESIFT-MSno
ProkaryotaEscherichia Colihuman bloodSIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaNeisseria Meningitidishuman bloodSIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaPseudomonas selectiveSIFT-MSno
ProkaryotaPseudomonas AeruginosaBlood agarSIFT-MSno
ProkaryotaPseudomonas AeruginosaBacT/ALERT FASIFT-MSno
ProkaryotaPseudomonas AeruginosaTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaStaphylococcus Aureushuman bloodSIFT-MSno
ProkaryotaStaphylococcus AureusBacT/ALERT FASIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStreptococcus Pneumoniaehuman bloodSIFT-MSno
ProkaryotaStreptococcus PyogenesTYESIFT-MSno
ProkaryotaHaemophilus InfluenzaeTryptic soya supp. factors X&VTD/GC-MSno
ProkaryotaPseudomonas Aeruginosatrypticase soy agarTD/GC-MSno
ProkaryotaPseudomonas Aeruginosatryptic soy brothTD/GC-MSno
ProkaryotaStaphylococcus Aureustryptic soy brothTD/GC-MSno
ProkaryotaStreptococcus PneumoniaeTryptic soyaTD/GC-MSno
ProkaryotaKlebsiella PneumoniaeLBSPME / GCxGC-TOFMSno
EukaryotaFusarium OxysporumLiquid onion extract medium (LOM)SPME, GC-MSyes
EukaryotaFusarium ProliferatumLiquid onion extract medium (LOM)SPME, GC-MSyes
ProkaryotaPseudomonas FluorescensNutrient AgarSPME-GC-MSno
ProkaryotaPseudomonas Sp.LB media, DYGS mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas Sp.LB mediaHS-SPME/GC-MSno
ProkaryotaPaenibacillus PolymyxaNA media, TSA mediaHS-SPME/GC-MSno
ProkaryotaPaenibacillus PolymyxaTSA mediaHS-SPME/GC-MSno
EukaryotaCandida AlbicansYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida GlabrataYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida TropicalisYGC mediaHS-SPME/GC-GC-ToFMSno
ProkaryotaBacillus Atrophaeusnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Amyloliquefaciensnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Licheniformisnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Pumilusnutrient agarHS-SPME/GC-MSno
EukaryotaTuber MagnatumGC-MS-Ono
ProkaryotaBacillus AmyloliquefaciensTryptic soy agarSPME coupled with GC-MSno
ProkaryotaBacillus SubtilisTryptic soy agarSPME coupled with GC-MSno
ProkaryotaPaenibacillus PolymyxaTryptic soy agarSPME coupled with GC-MSno
ProkaryotaAlpha Proteobacterian/an/ano
ProkaryotaGamma Proteobacterian/an/ano
ProkaryotaAlcaligenes Faecalisn/an/ano
ProkaryotaDesulfovibrio Acrylicusn/an/ano
ProkaryotaParasporobacterium Paucivoransn/an/ano
ProkaryotaLactococcus Sp.n/an/ano
ProkaryotaLactobacillus Sp.n/an/ano
ProkaryotaLactobacillus Lactisn/an/ano
ProkaryotaBrevibacterium Linensn/an/ano
ProkaryotaOenococcus Oenin/an/ano
ProkaryotaLactobacillus Brevisn/an/ano
ProkaryotaLactobacillus Hilgardiin/an/ano
ProkaryotaLactobacillus Plantarumn/an/ano
ProkaryotaPorphyromonas Gingivalisn/an/ano
ProkaryotaFusobacterium Nucleatumn/an/ano
ProkaryotaTreponema Denticolan/an/ano
ProkaryotaCitrobacter Freundiin/an/ano
ProkaryotaEscherichia Colin/an/ano
ProkaryotaShigella Flexnerin/an/ano
ProkaryotaSalmonella Enterican/an/ano
EukaryotaCandida Tropicalisn/an/ano
EukaryotaTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
ProkaryotaPseudomonas PutidaAB medium + 1% citrate or 0,02% citrate or 1% glucose +1% casaminoacid GC-FID,GC/MSno
ProkaryotaPseudomonas TolaasiiKBSPME-GCno
ProkaryotaPseudomonas PutidaKing's B AgarSPME-GC/MSno
ProkaryotaRalstonia SolanacearumCasamino Acid Peptone Glucose agarSPME-GC/MSno
ProkaryotaKlebsiella PneumoniaeLB GCxGC-TOF-MSno
EukaryotaSchizophyllum Communen/an/ano
ProkaryotaStreptococcus PneumoniaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaPseudomonas PerolensTrypticase soil agar (BBL)GC/MSno
ProkaryotaAchromobacter Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaSerratia Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaEnterobacter Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaEscherichia ColiLB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisMOLPHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus Vulpistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
Microbacteriumtryptone soy (TS medium; Carl Roth, Karlsruhe, Germany)GC-QQQ-MSno


Compound Details

Synonymous names
CARBON DISULFIDE
Carbon disulphide
Carbon bisulfide
75-15-0
Carbon bisulphide
Dithiocarbonic anhydride
Schwefelkohlenstoff
Weeviltox
Wegla dwusiarczek
Solfuro di carbonio
methanedithione
Sulphocarbonic anhydride
Sulphuret of carbon
disulfidocarbon
CARBONDISULFIDE
RCRA waste number P022
Caswell No. 162
NCI-C04591
Carbon bisulfuret
Alcohol of sulfur
Sulfure de carbone
Koolstofdisulfide (zwavelkoolstof)
Kohlendisulfid (schwefelkohlenstoff)
HSDB 52
Carbone (sulfure de)
Carbonio (solfuro di)
CCRIS 5570
Carbon sulfide (CS2)
Carbon sulphide
UN 1131
EINECS 200-843-6
EPA Pesticide Chemical Code 016401
UNII-S54S8B99E8
BRN 1098293
CS2
DTXSID6023947
CHEBI:23012
Sulfocarbonic anhydride
AI3-08935
Sulfure de carbone [ISO-French]
S54S8B99E8
CARBONEUM SULPHURATUM
Carbon disulfide, ACS reagent
DTXCID103947
CARBON DISULFIDE (13C)
EC 200-843-6
4-03-00-00395 (Beilstein Handbook Reference)
12539-80-9
NCGC00091108-01
Carbondisulphide
CARBON DISULFIDE (MART.)
CARBON DISULFIDE [MART.]
Sulfure de carbone (ISO-French)
Carbon disulfide cation
Wegla dwusiarczek [Polish]
Disulfide, Carbon
CAS-75-15-0
Schwefelkohlenstoff [German]
Carbon disulfide [BSI:ISO]
Carbon disulfide, ACS reagent, >=99.9%
Solfuro di carbonio [Italian]
Carbone (sulfure de) [French]
Carbonio (solfuro di) [Italian]
UN1131
RCRA waste no. P022
Carbon disulfide, puriss., low in benzene, >=99.5% (GC)
Dithioxomethane
Kohlendisulfid
Koolstofdisulfide (zwavelkoolstof) [Dutch]
Koolstofdisulfide
carbon-disulphide
Kohlendisulfid (schwefelkohlenstoff) [German]
Dithioxomethane #
Carbon-disulphide-
Carbone (sufure de)
Caswell No 162
Carbon disulfide, CP
Carbon disulphide, BSI
HEADACHE RHEUMATISM
CARBON DISULFIDE [MI]
CARBON DISULFIDE [ISO]
CARBON DISULFIDE [HSDB]
CHEMBL1365180
CARBON DISULFIDE [WHO-DD]
Carbon disulfide, p.a., 99.5%
CARBONEUM SULPHURATUM [HPUS]
Tox21_111082
Tox21_201168
CARBON DISULFIDE [GREEN BOOK]
Carbon disulfide, anhydrous, >=99%
AKOS009075983
USEPA/OPP Pesticide Code: 016401
NCGC00091108-02
NCGC00258720-01
Carbon disulfide, for HPLC, >=99.9%
CARBON DISULFIDE (CARBON BISULFIDE)
Carbondisulfide 100 microg/ml in Methanol
Carbon disulfide, purum, >=99.0% (GC)
Carbondisulfide 5000 microg/mL in Methanol
C1955
Carbon-12C disulfide, 99.9 atom % 12C
NS00040573
Carbon disulfide 5000 microg/mL in Methanol
Carbon disulfide, puriss., >=99.5% (GC)
C19033
Carbon disulfide, SAJ first grade, >=98.0%
Carbon disulfide [UN1131] [Flammable liquid]
Carbon disulfide, JIS special grade, >=99.0%
Carbon disulfide, spectrophotometric grade, >=99%
Q243354
Carbon disulfide, puriss. p.a., >=99.9% (GC)
Carbon disulfide, ReagentPlus(R), low benzene, >=99.9%
Carbon disulfide, ReagentPlus(R), purified by redistillation, >=99.9%
Carbon disulfide, for IR spectroscopy, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99.9% (GC)
Microorganism:

Yes

IUPAC name
SMILESC(=S)=S
InchiInChI=1S/CS2/c2-1-3
FormulaCS2
PubChem ID6348
Molweight76.15
LogP2.1
Atoms3
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationsulfides sulfur compounds
CHEBI-ID23012
Supernatural-IDSN0304680

mVOC Specific Details

Boiling Point
DegreeReference
46.2 °C peer reviewed
Volatilization
The Henry's Law constant for carbon disulfide is 1.44X10-2 atm-cu m/mole at 24 deg C(1). This Henry's Law constant indicates that carbon disulfide is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the estimated volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec) (2) is approximately 2.6 hours(SRC). The estimated volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec) (2)is approximately 3.5 days(SRC). Carbon disulfide's Henry's Law constant(1) indicates that volatilization from moist soil surfaces is expected to occur(SRC). The potential for volatilization of carbon disulfide from dry soil surfaces may exist(SRC) based upon the vapor pressure of 359 mm Hg(3).
Literature: (1) Elliot S; Atmos Environ 23: 1977-80 (1989) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Yaws CL; Handbook of Vapor Pressure, Vol 1, Houston,TX: Gulf Pub Co (1994)
Soil Adsorption
The Koc of carbon disulfide is estimated as approximately 270(SRC), using a log Kow of 1.94(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that carbon disulfide is expected to have moderate mobility in soil(SRC). The avg adsorption of carbon disulfide after 10 minutes by 4 air-dried soils was 46% but only 12% by the same soils at 50% water-holding capacity(4). However, after 8 hr the rate of adsorption was greater by moist soil, but only when the soil was unsterilized(4). Further experiments suggest that this 'adsorption' in moist soils is the result of microbial action(4).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR (consult ed) Washington,DC: Amer Chem Soc p 3 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington,DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983) (4) Bremner JM, Banwart WL; Soil Biol Biochem 8: 79-83 (1976)
Vapor Pressure
PressureReference
359 mm Hg at 25 deg CYaws CL; Handbook of Vapor Pressure, Vol 1, Houston,TX: Gulf Pub Co. (1994)
MS-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaKlebsiella PneumoniaeNANARees et al. 2016a
ProkaryotaHaemophilus InfluenzaeNANAFilipiak et al. 2012
ProkaryotaStreptococcus PneumoniaeNANAFilipiak et al. 2012
EukaryotaFusarium OxysporumonionWang et al. 2018
EukaryotaFusarium ProliferatumonionWang et al. 2018
ProkaryotaPseudomonas Putidan/aNASchulz and Dickschat 2007
ProkaryotaSerratia Proteamaculansn/aNAErcolini et al. 2009
ProkaryotaCarnobacterium Divergensn/aNAErcolini et al. 2009
ProkaryotaPseudomonas Fragin/aNAErcolini et al. 2009
EukaryotaOgataea Pininamycangia of Dendroctonus brevicomisDavis et al. 2011
ProkaryotaPseudomonas PutidananaSchöller et al. 1997
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaKlebsiella Pneumoniaehuman bloodSPME/GCxGC-MSno
ProkaryotaHaemophilus InfluenzaeTryptic soya supp. factors X&VTD/GC-MSno
ProkaryotaStreptococcus PneumoniaeTryptic soyaTD/GC-MSno
EukaryotaFusarium OxysporumLiquid onion extract medium (LOM)SPME, GC-MSyes
EukaryotaFusarium ProliferatumLiquid onion extract medium (LOM)SPME, GC-MSyes
ProkaryotaPseudomonas Putidan/an/ano
ProkaryotaSerratia Proteamaculansn/an/ano
ProkaryotaCarnobacterium Divergensn/an/ano
ProkaryotaPseudomonas Fragin/an/ano
EukaryotaOgataea PiniMEAGC/MSno
ProkaryotaPseudomonas PutidaAB medium + 1% citrate or 0,02% citrate or 1% glucose +1% casaminoacid GC-FID,GC/MSno


Methylsulfanylmethane

Mass-Spectra

Compound Details

Synonymous names
dimethyl sulfide
Methyl sulfide
75-18-3
Methane, thiobis-
dimethyl sulphide
dimethylsulfide
Methyl thioether
Dimethylsulphide
2-Thiapropane
Dimethyl thioether
Methyl sulphide
METHYLSULFANYLMETHANE
Methylthiomethane
Dimethylsulfid
(Methylsulfanyl)methane
Methyl monosulfide
Dimethyl monosulfide
Thiobismethane
2-Thiopropane
Methanethiomethane
Thiobis(methane)
Exact-S
Sulfure de methyle
Dimethyl sulfide (natural)
dimethylsulfane
FEMA No. 2746
Methylthiomethyl radical
MFCD00008562
Methane, 1,1'-thiobis-
[SMe2]
QS3J7O7L3U
CHEBI:17437
(CH3)2S
31533-72-9
methylsulfide
Dimethylsulfid [Czech]
Sulfure de methyle [French]
HSDB 356
EINECS 200-846-2
UN1164
UNII-QS3J7O7L3U
BRN 1696847
Methylsulphide
Thiopropane
Thiobis-methane
di-methylsulfide
AI3-25274
Dimethyl sulfane
Sulfide, methyl-
(methylthio)methane
Me2S
REDUCED-DMSO
SMe2
Dimethyl sulfide, 98%
reduced dimethyl sulfoxide
(Methylsulfanyl)methane #
Dimethyl sulfide [UN1164] [Flammable liquid]
Dimethyl sulfoxide(Reduced)
EC 200-846-2
(Me)2S
Dimethyl sulfide, >=99%
4-01-00-01275 (Beilstein Handbook Reference)
CHEMBL15580
DIMETHYL SULFIDE [MI]
METHYL SULFIDE [FHFI]
DIMETHYL SULFIDE [FCC]
DIMETHYL SULFIDE [HSDB]
DTXSID9026398
S(CH3)2
Dimethyl sulfide, >=99%, FCC
Dimethyl sulfide, analytical standard
STL481894
Dimethyl sulfide, >=95.0% (GC)
AKOS009031411
MCULE-4525381422
UN 1164
Dimethyl sulfide, anhydrous, >=99.0%
InChI=1/C2H6S/c1-3-2/h1-2H
M0431
NS00005000
NS00124710
Dimethyl sulfide, puriss., >=99.0% (GC)
C00580
Dimethyl sulfide, natural, >=99%, FCC, FG
Dimethyl sulfide [UN1164] [Flammable liquid]
A838342
Dimethyl sulfide, redistilled, >=99%, FCC, FG
Q423133
Q-100810
Microorganism:

Yes

IUPAC namemethylsulfanylmethane
SMILESCSC
InchiInChI=1S/C2H6S/c1-3-2/h1-2H3
FormulaC2H6S
PubChem ID1068
Molweight62.14
LogP0.9
Atoms3
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationsulfides thioethers sulfur compounds
CHEBI-ID17437
Supernatural-IDSN0309416

mVOC Specific Details

Boiling Point
DegreeReference
37.3 °C peer reviewed
Volatilization
The Henry's Law constant for dimethyl sulfide has been measured as 1.61X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that dimethyl sulfide is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 3 days(SRC). Dimethyl sulfides's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of dimethyl sulfide from dry soil surfaces may exist(SRC) based upon a vapor pressure of 502 mm Hg(3).
Literature: (1) Gaffney, JS et al; Env Sci Tech 21: 519-23 (1987) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Vol 4. Design Inst Phys Prop Data, Amer Inst Chem Eng, NY, NY: Hemisphere Pub Corp (1989)
Soil Adsorption
The Koc of dimethyl sulfide is estimated as 6.3(SRC), using a water solubility of 22,000 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that dimethyl sulfide is expected to have very high mobility in soil.
Literature: (1) Suzuki T; J Comp-Aided Molec Des 5: 149-66 (1991) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.0. Jan, 2009. Available from http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm as of Oct 1, 2009. (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Literature: #Air-dried, unsterilized moist, and sterilized moist soils exposed to air initially containing 500 ppm dimethyl sulfide adsorbed an avg of 32, 308, and 10 ug dimethyl sulfide/g soil, respectively, in 15 days(1). Time required for complete sorption of dimethyl sulfide by moist soil from air initially containing 100 ppm dimethyl sulfide: soil 1 (Weller) - 1st exposure 150 min, 2nd exposure 100 min, 3rd exposure 95 min; soil 2 (Harps) - 1st exposure 45 min, 2nd exposure 24 min, 3rd exposure 19 min(1). These data suggest that moist soils have a greater tendency to adsorb dimethyl sulfide than dry soils, and that microbial activity in moist soils may be responsible for greater adsorption(1). When natural gas containing 0.5 pounds of dimethyl sulfide per million cubic feet of gas was passed through a bed of pulverized, dry, montmorillonite clay, dimethyl sulfide exhibited a fast breakthrough (2 hours) and a fast build-up rate in effluent gas (85% of influent concn 4 hours after breakthrough), suggesting that dimethyl sulfide does not adsorb to dry soils(2).
Literature: (1) Bremner JM, Banwart WL; Soil Biol Biochem 8: 79-83 (1976) (2) Williams RP; Oper Sect Proc - Am Gas Assoc pp. T29-T37 (1976)
Vapor Pressure
PressureReference
502 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAChippendale et al. 2014
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaNeisseria MeningitidisNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAHewett et al. 2020
ProkaryotaPseudomonas AeruginosaNANABean et al. 2016
ProkaryotaKlebsiella PneumoniaeNANARees et al. 2016a
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
ProkaryotaEscherichia ColiNANADixon et al. 2022
ProkaryotaHaemophilus InfluenzaeNANAFilipiak et al. 2012
ProkaryotaPseudomonas AeruginosaNANAFilipiak et al. 2012
ProkaryotaPseudomonas AeruginosaNANAAhmed et al. 2023
ProkaryotaStreptococcus PneumoniaeNANAFilipiak et al. 2012
ProkaryotaMycobacterium BovisNANAMcNerney et al. 2012
ProkaryotaEnterobacter CloacaeNALawal et al. 2018
EukaryotaAspergillus Versicolorwild strainsSchleibinger et al. 2005
EukaryotaChaetomium Globosumwild strainsSchleibinger et al. 2005
EukaryotaEurotium Amstelodamiwild strainsSchleibinger et al. 2005
ProkaryotaShigella SonneiChina Center of Industrial Culture collectionWang et al. 2018
ProkaryotaVibrio ParahaemolyticusChina Center of Industrial Culture collectionWang et al. 2018
EukaryotaFusarium OxysporumonionWang et al. 2018
EukaryotaFusarium ProliferatumonionWang et al. 2018
ProkaryotaPseudomonas Fluorescens0Medicago spp. plant rhizospheresHernández-León et al. 2015
ProkaryotaPseudomonas Sp.antifungal activity against Thielaviopsis ethacetica mycelial growthBrazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; BrazilFreitas et al. 2022
ProkaryotaPseudomonas AeruginosaNational Collections of Industrial Food and Marine Bacteria, American Type Culture CollectionSlade et al. 2022
EukaryotaTuber Magnatumcollected from natural truffle orchards in Istria (Croatia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Baranya (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Somogy (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Abruzzo (Italy) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Kalubara (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Srem (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaSerendipita IndicaInstitute of Phytopathology, Justus-Liebig-Universität, Gießen, Germany; origin: isolates from sudangrass roots growing in soil-based trap systemsVenneman et al. 2020
EukaryotaSerendipita WilliamsiiInstitute of Phytopathology, Justus-Liebig-Universität, Gießen, Germany; origin: isolates from sudangrass roots growing in soil-based trap systemsVenneman et al. 2020
ProkaryotaAlpha Proteobacterian/aNASchulz and Dickschat 2007
ProkaryotaGamma Proteobacterian/aNASchulz and Dickschat 2007
ProkaryotaAlcaligenes Faecalisn/aNASchulz and Dickschat 2007
ProkaryotaDesulfovibrio Acrylicusn/aNASchulz and Dickschat 2007
ProkaryotaParasporobacterium Paucivoransn/aNASchulz and Dickschat 2007
ProkaryotaLactococcus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaClostridium Sp.n/aNAStotzky and Schenck 1976
ProkaryotaCollimonas Fungivoransn/aNAGarbeva et al. 2014
EukaryotaTuber Magnatumn/aItalian geographical areas ( Umbria, Piedmont, Marche, Emilia Romagna, Border region area between Emilia Romagna and Marche, Tuscany, Molise)Gioacchini et al. 2008
EukaryotaTuber Simonean/aAyme Truffe of Grignan, 26230 FranceMarch et al. 2006
EukaryotaTuber Rufumn/aAyme Truffe of Grignan, 26230 FranceMarch et al. 2006
EukaryotaTuber Mesentericumn/aAyme Truffe of Grignan, 26230 FranceMarch et al. 2006
EukaryotaTuber Melanosporumn/aAyme Truffe of Grignan, 26230 FranceMarch et al. 2006
EukaryotaTuber Aestivumn/aAyme Truffe of Grignan, 26230 FranceMarch et al. 2006
EukaryotaTuber Uncinatumn/aFrance, Italy, Switzerland, the UK, Austria, Romania, and HungarySplivallo et al. 2012
ProkaryotaCollimonas Pratensisn/aNAGarbeva et al. 2014
ProkaryotaPseudomonas FluorescensNACheng et al. 2016
EukaryotaFusarium Sp.NABrock et al. 2011
EukaryotaPenicillium Sp.NALarsen 1998
ProkaryotaPseudonocardia ThermophilanasoilWilkins 1996
ProkaryotaSaccharomonospora RectivirgulanasoilWilkins 1996
ProkaryotaStreptomyces Sp.nabreathing zone of a waste collection workerWilkins 1996
ProkaryotaPseudomonas Aeruginosastimulates growth of Aspergillus fumigatusnaBriard et al. 2016
ProkaryotaSerratia Plymuthicanamaize rhizosphere, NetherlandsGarbeva et al. 2014
ProkaryotaPaenibacillus Sp.narhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al. 2014
ProkaryotaPedobacter Sp.narhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al. 2014
ProkaryotaRalstonia SolanacearumnanaSpraker et al. 2014
EukaryotaPenicillium Communenain dry-cured meat products, cheeseSunesson et al. 1995
ProkaryotaSerratia Sp.the results led us to propose a possible new direct long-distance mechanism of action for WT antagonistic F. oxysporum that is mediated by vocsNAMinerdi et al. 2009
EukaryotaTuber Aestivumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
EukaryotaTuber Melanosporumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
ProkaryotaPseudomonas PutidananaSchöller et al. 1997
EukaryotaTuber Mesentericumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Excavatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Magnatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Aestivumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Brumalen/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Melanosporumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al. 2004
ProkaryotaPseudomonas AeruginosaclinicPreti et al. 2009
ProkaryotaEnterobacter AgglomeransNARobacker and Lauzon 2002
ProkaryotaClostridium Difficilenastool specimens, from patients infected with clostridium difficileKuppusami et al. 2015
ProkaryotaClostridium DifficilenanaKuppusami et al. 2015
EukaryotaTuber MesentericumNoneNoneMarch et al. 2006
ProkaryotaSerratia Sp.NANAAlmeida et al. 2022
ProkaryotaEnterobacter Sp.NANAAlmeida et al. 2022
ProkaryotaEscherichia ColiNANAAlmeida et al. 2022
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusBHIGC-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaEscherichia Colihuman bloodSIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaNeisseria Meningitidishuman bloodSIFT-MSno
ProkaryotaPseudomonas Aeruginosahuman bloodSIFT-MSno
ProkaryotaPseudomonas AeruginosaBacT/ALERT FASIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaStaphylococcus Aureushuman bloodSIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStreptococcus Pneumoniaehuman bloodSIFT-MSno
ProkaryotaStreptococcus PneumoniaeBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiLBSPME/GC-MSno
ProkaryotaPseudomonas AeruginosaLB-LennoxSPME/GC-MSno
ProkaryotaKlebsiella Pneumoniaehuman bloodSPME/GCxGC-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
ProkaryotaEscherichia ColiLBTD/GC-MSno
ProkaryotaHaemophilus InfluenzaeTryptic soya supp. factors X&VTD/GC-MSno
ProkaryotaPseudomonas Aeruginosatryptic soy brothTD/GC-MSno
ProkaryotaPseudomonas AeruginosaNBTD/GC-MSno
ProkaryotaStreptococcus PneumoniaeTryptic soyaTD/GC-MSno
ProkaryotaMycobacterium BovisLG + glycerolTD/GC-MS and SIFT-MSno
ProkaryotaEnterobacter CloacaeLevine EMB agar (LEA) (Fluka Analytical, UK)GC-MSno
EukaryotaAspergillus Versicoloringrain (woodchip)SIM/GCMS / Tenaxno
EukaryotaChaetomium Globosumingrain (woodchip)SIM/GCMS / Tenaxno
EukaryotaEurotium Amstelodamiingrain (woodchip)SIM/GCMS / Tenaxno
ProkaryotaShigella SonneiSodium chloride brothSPME, GC-MSno
ProkaryotaVibrio ParahaemolyticusSodium chloride brothSPME, GC-MSno
EukaryotaFusarium OxysporumLiquid onion extract medium (LOM)SPME, GC-MSyes
EukaryotaFusarium ProliferatumLiquid onion extract medium (LOM)SPME, GC-MSyes
ProkaryotaPseudomonas FluorescensNutrient AgarSPME-GC-MSno
ProkaryotaPseudomonas Sp.LB media, DYGS media, ANGLE mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTS agar/blood agarHS-SPME/GC-MSno
EukaryotaTuber MagnatumGC-MS-Ono
EukaryotaSerendipita IndicaPD agarPTR-TOF-MSno
EukaryotaSerendipita WilliamsiiPD agarPTR-TOF-MSno
ProkaryotaAlpha Proteobacterian/an/ano
ProkaryotaGamma Proteobacterian/an/ano
ProkaryotaAlcaligenes Faecalisn/an/ano
ProkaryotaDesulfovibrio Acrylicusn/an/ano
ProkaryotaParasporobacterium Paucivoransn/an/ano
ProkaryotaLactococcus Sp.n/an/ano
ProkaryotaLactobacillus Sp.n/an/ano
ProkaryotaClostridium Sp.n/an/ano
ProkaryotaCollimonas Fungivoranssand supplemented with artificial root exudatesHeadspace trapping/GC-MSno
EukaryotaTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MSno
EukaryotaTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MSno
EukaryotaTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MSno
EukaryotaTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MSno
EukaryotaTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MSno
EukaryotaTuber Uncinatumn/aSPME-GC-MSno
ProkaryotaCollimonas Pratensissand supplemented with artificial root exudatesHeadspace trapping/GC-MSno
ProkaryotaPseudomonas FluorescensKings B + rif,+kann; PDA GC-Q-TOF-MSno
EukaryotaFusarium Sp.no
EukaryotaPenicillium Sp.no
ProkaryotaPseudonocardia ThermophilaNutrient agar CM3GC/MSno
ProkaryotaSaccharomonospora RectivirgulaNutrient agar CM3GC/MSno
ProkaryotaStreptomyces Sp.Nutrient agar CM3 + 50mg/l actidioneGC/MSno
ProkaryotaPseudomonas Aeruginosaminimal medium/ Brian mediumSPME-GC/MSno
ProkaryotaSerratia Plymuthicasand containing artificial root exudatesGC/MSno
ProkaryotaPaenibacillus Sp.sand containing artificial root exudatesGC/MSno
ProkaryotaPedobacter Sp.sand containing artificial root exudatesGC/MSno
ProkaryotaRalstonia SolanacearumCasamino Acid Peptone Glucose agarSPME-GC/MSno
EukaryotaPenicillium CommuneMEAGC/MSno
ProkaryotaSerratia Sp.LB mediumSPME/GC-MS no
EukaryotaTuber Aestivumn/aGas chromatography-olfactometry (GC-O)no
EukaryotaTuber Melanosporumn/aGas chromatography-olfactometry (GC-O)no
ProkaryotaPseudomonas PutidaAB medium + 1% citrate or 0,02% citrate or 1% glucose +1% casaminoacid GC-FID,GC/MSno
EukaryotaTuber Mesentericumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Melanosporumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
ProkaryotaPseudomonas AeruginosaBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaEnterobacter Agglomeransno
ProkaryotaClostridium Difficilebrain heart infusion agar with 7% horse bloodPTR-ToF-MSno
EukaryotaTuber MesentericumNonePressure balanced head-space sampling and GC/TOF-MSno
ProkaryotaSerratia Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaEnterobacter Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaEscherichia ColiLB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
ProkaryotaPseudomonas SegetisMOLPHS-SPME-GC/MSno
ProkaryotaPseudomonas SegetisSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas Segetistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno


Sulfane

Compound Details

Synonymous names
hydrogen sulfide
sulfane
Hydrosulfuric acid
Dihydrogen monosulfide
Stink DAMP
Hydrogen sulphide
Dihydrogen sulfide
Sulfureted hydrogen
7783-06-4
Sewer gas
Hydrogene sulfure
Acide sulfhydrique
Schwefelwasserstoff
Netzschwefel
Zwavelwaterstof
Kolospray
Liquamat
Micowetsulf
Microflotox
Siarkowodor
Colsul
Crystex
Elosal
Hexasul
Kolofog
Kumulus
Sastid
Cosan
Hydrogen sulfide (H2S)
Polsulkol Extra
Hydrogen-sulfide
Idrogeno solforato
Corosul D and S
RC-Schwefel Extra
Hydrogen monosulfide
Kolloidschwefel 95
Sulfuretted hydrogen
Cosan 80
Hepatic acid
Hydrogene sulphure
Kolo 100
Acide sulphhydrique
RCRA waste number U135
Hydrogen sulfuric acid
dihydridosulfur
FEMA No. 3779
UN 1053
YY9FVM7NSN
CHEBI:16136
Hepatic gas
Hydrogen sulfure
H2S
dihydrogen(sulfide)
sulfure d'hydrogene
Sulfur-32S
HSDB 576
CHEBI:26833
UNII-YY9FVM7NSN
EINECS 231-977-3
NSC-403664
SULPHUR HYDROGENISATUM
DIHYDROGEN MONOSULPHIDE
DTXSID4024149
Collokit
Kristex
Microthiol
Shreesul
Kumulus FL
Sulfur-(32-S)
EC 231-977-3
Magnetic 6
Caswell No. 812
azufre
HYDROGEN SULFIDE (MART.)
HYDROGEN SULFIDE [MART.]
mercaptans
thiols
(SH2)
[SH2]
Proactiv
Transact
Schwefel, feinverteilter
Thiol
Sulfide, Hydrogen
Siarkowodor [Polish]
Hydrogen sulfide H2S
Magnetic 70, 90, and 95
HSDB 5166
Sulfur - S @ 0 microg/g in Heavy Mineral Oil
Sulfur - S @ 1.00 wt% in Heavy Mineral Oil
Sulfur Standard: S @ 10000 microg/mL in H2O
Sulfur Standard: S BLK (0 wt%) in Crude Oil
Zwavelwaterstof [Dutch]
Sulfur - S @ 500 microg/g in Heavy Mineral Oil
EINECS 231-722-6
NA1350
NA2448
UN1350
UN2448
Hydrogen sulfure [French]
RCRA waste no. U135
EPA Pesticide Chemical Code 077501
Hydrogene sulfure [French]
NSC 403664
Acide sulfhydrique [French]
monosulfane
Schwefelwasserstoff [German]
theion
Hydrosulfurate
Idrogeno solforato [Italian]
Acnaveen
Cuticura
Eskamel
Hepatate
Merkaptan
Schwefel
Acnil
Meted
Sulfur,sublimed
a thiol
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in Crude Oil
Sulfur Standard: S @ 10000 microg/g (1.00 wt%) in Crude Oil
Sulfur Standard: S @ 20000 microg/g (2.00 wt%) in Crude Oil
Sulfur Standard: S @ 2500 microg/g (0.250 wt%) in Crude Oil
Sulfur Standard: S @ 30000 microg/g (3.00 wt%) in Crude Oil
Sulfur Standard: S @ 40000 microg/g (4.00 wt%) in Crude Oil
Sulfur Standard: S @ 5000 microg/g (0.500 wt%) in Crude Oil
Sulfur Standard: S @ 50000 microg/g (5.00 wt%) in Crude Oil
Sulfur,colloidal
Sour gas
Sulfur, molten
37331-50-3
Colloidal sulphur
Dome-Acne
intracellular S0
Sulfur Standard: S @ 7500 microg/g (0.750 wt%) in 20 cSt Mineral Oil
Sulfur (Powder)
Sulfur, colloidal
Bensulfoid (TN)
Dihydrogen sulphide
Sulfur,precipitated
RSH
Sastid (TN)
UN1053
component of Bensulfoid
SULFUR DIHYDRIDE
Sour gas (Salt/Mix)
Sulfur (>80%)
Sulfur (>98%)
Magnetic 70, and 95
EC 231-722-6
SULPHURETTED HYDROGEN
HYDROGEN SULFIDE [MI]
SULFUR HYDRIDE (SH2)
DTXCID404149
Hydrogen sulfide, >=99.5%
HYDROGEN SULFIDE [FHFI]
HYDROGEN SULFIDE [HSDB]
CHEMBL1200739
CHEMBL2105487
NIOSH/MX1229000
CHEBI:29256
Sulfur Blank (0%) in Isooctane
PXQLVRUNWNTZOS-UHFFFAOYSA-N
DTXSID201029845
HYDROGEN SULFIDE, LIQUEFIED
HYDROGEN SULPHIDE, LIQUEFIED
Sulfur Blank (0 wt%) in Kerosene
Sulfur [NA1350] [Class 9]
BDBM50147625
BDBM50498447
NSC403664
Sulfur Blank (0 wt%) in Isooctane
SULPHUR HYDROGENISATUM [HPUS]
Hydrogen sulfide, purum, >=99.0%
AKOS015833648
AKOS015950634
Sulfur - S @15microg/g, 500 mL
Sulphur in Diesel, Low (7.2 mg/kg)
Sulfur [UN1350] [Flammable solid]
Sulfur Blank (0%) in Synthetic Diesel
Sulfur @ 7000microg/g in Residual Oil
BP-21056
Q682
Sulfur Blank (0%) in Heavy Mineral Oil
Sulfur Blank (0%) in Light Mineral Oil
Sulfur Blank (0%) in Odourless Kerosene
Sulfur, molten [NA2448] [Class 9]
Hydrogen sulfide [UN1053] [Poison gas]
Sulfur @ 0.0005% (5ppm) in Isooctane
Sulfur @ 0.001% (10ppm) in Isooctane
Sulfur @ 0.005% (50ppm) in Isooctane
Sulfur @ 0.01% (100ppm) in Isooctane
Sulfur @ 0.03% (300ppm) in Isooctane
Sulfur @ 0.05% (500ppm) in Isooctane
Sulfur @ 0.07% (700ppm) in Isooctane
Sulfur @ 0.1% (1000ppm) in Isooctane
Sulfur @ 0.3% (3000ppm) in Isooctane
Sulfur Blank (0 wt%) in #2 Diesel Fuel
MX12290000
NS00075432
PTP Sample for Sulfur in Isooctane Analysis
Sulfur - S @ 2.00 wt% in Heavy Mineral
Sulfur @ 0.0025% (25ppm) in Isooctane
Sulfur @ 0.025% (250ppm) in Isooctane
Sulfur @ 0.075% (750ppm) in Isooctane
Sulfur @ 0.25% (2500ppm) in Isooctane
Sulfur @ 10 microg/g, from Polysulfide Oil
U0149
Sulfur - S @ 2% in Residual Oil, 500mL
Sulfur, powder, 99.998% trace metals basis
C00087
C00283
D00024
F21255
Sulfur - S @ 0ug/g in Light Mineral, 1 gal
Sulfur - S @ 1% in Residual Oil, 1 Gallon
Sulfur - S @ 200microg/g in #2 Diesel fuel
Sulfur - S @ 4% in Residual Oil, 1 Gallon
Sulfur - S @ 400microg/g in #2 Diesel fuel
Sulfur - S @ 5% in Residual Oil, 1 Gallon
Sulfur @ 1% (10000ppm) in Synthetic Diesel
Sulfur @ 2% (20000ppm) in Synthetic Diesel
Sulfur @ 3% (30000ppm) in Synthetic Diesel
Sulfur @ 4% (40000ppm) in Synthetic Diesel
Sulfur @ 5% (50000ppm) in Synthetic Diesel
Sulfur Blank (0 wt%) in 20 cSt Mineral Oil
Sulfur Blank (0 wt%) in 75 cSt Mineral Oil
Sulfur, molten [UN2448] [Flammable solid]
di-n-butyl sulfide, S @ 22% nominally, 100g
Sulfur - S @ 2% in Resdidual Oil , 1 Gallon
Sulfur - S @ 3% in Residual Oil , 1 Gallon
Sulfur - S @ 3.00 wt% in Heavy Mineral Oil
Sulfur - S @ 4.00 wt% in Heavy Mineral Oil
Sulfur - S @ 400ug/g in #2 Diesel Fuel, L
Sulfur - S @ 5 microg/g in Heavy Mineral Oil
Sulfur - S @ 5.00 wt% in Heavy Mineral Oil
Sulfur @ 0.0005% (5ppm) in Synthetic Diesel
Sulfur @ 0.001% (10ppm) in Synthetic Diesel
Sulfur @ 0.005% (50ppm) in Synthetic Diesel
Sulfur @ 0.01% (100ppm) in Synthetic Diesel
Sulfur @ 0.03% (300ppm) in Synthetic Diesel
Sulfur @ 0.05% (500ppm) in Synthetic Diesel
Sulfur @ 0.07% (700ppm) in Synthetic Diesel
Sulfur @ 0.1% (1000ppm) in Synthetic Diesel
Sulfur @ 0.3% (3000ppm) in Synthetic Diesel
Sulfur @ 0.5% (5000ppm) in Synthetic Diesel
Sulfur @ 1% (10000ppm) in Odourless Kerosene
Sulfur @ 2% (20000ppm) in Odourless Kerosene
Sulfur @ 3% (30000ppm) in Odourless Kerosene
Sulfur @ 4% (40000ppm) in Odourless Kerosene
Sulfur @ 5% (50000ppm) in Odourless Kerosene
Sulfur in Residual Oil @ 10,000microg/g, 1L
Sulfur in Residual Oil @ 20,000microg/g, 1L
Sulfur in Residual Oil @ 30,000microg/g, 1L
Sulfur in Residual Oil @ 40,000microg/g, 1L
Sulfur in Residual Oil @ 50,000microg/g, 1L
Sulfur Standard: S @ 250microg/g in Isooctane
A857440
PTP Sample for Sulfur in #2 Diesel Fuel Analysis
PTP Sample for Sulfur in B100 Biodiesel Analysis
Q170591
Sulfur - S @ 0.300 wt% in Heavy Mineral Oil
Sulfur - S @ 0.500 wt% in Heavy Mineral Oil
Sulfur - S @ 0.750 wt% in Heavy Mineral Oil
Sulfur - S @ 0ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 10 microg/g in Heavy Mineral Oil
Sulfur - S @ 100microg/g in Heavy Mineral Oil
Sulfur - S @ 1500microg/g in Heavy Mineral Oil
Sulfur - S @ 20 microg/g in Heavy Mineral Oil
Sulfur - S @ 200 microg/g in Heavy Mineral Oil
Sulfur - S @ 25 microg/g in Heavy Mineral Oil
Sulfur - S @ 2wt% in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 3.00wt% in #2 Diesel, 500mL
Sulfur - S @ 3.00wt% in Residual Oil, 500mL
Sulfur - S @ 300 microg/g in Heavy Mineral Oil
Sulfur - S @ 4.00wt% in Residual Oil, 500mL
Sulfur - S @ 5.00wt% in Residual Oil, 500mL
Sulfur - S @ 50 microg/g in Heavy Mineral Oil
Sulfur - S @ 5ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 5ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 750 microg/g in Heavy Mineral Oil
Sulfur @ 0.0005% (5ppm) in Heavy Mineral Oil
Sulfur @ 0.0005% (5ppm) in Light Mineral Oil
Sulfur @ 0.0005% (5ppm) in Odourless Kerosene
Sulfur @ 0.001% (10ppm) in Heavy Mineral Oil
Sulfur @ 0.001% (10ppm) in Light Mineral Oil
Sulfur @ 0.001% (10ppm) in Odourless Kerosene
Sulfur @ 0.0025% (25ppm) in Synthetic Diesel
Sulfur @ 0.005% (50ppm) in Heavy Mineral Oil
Sulfur @ 0.005% (50ppm) in Light Mineral Oil
Sulfur @ 0.005% (50ppm) in Odourless Kerosene
Sulfur @ 0.01% (100ppm) in Heavy Mineral Oil
Sulfur @ 0.01% (100ppm) in Light Mineral Oil
Sulfur @ 0.01% (100ppm) in Odourless Kerosene
Sulfur @ 0.025% (250ppm) in Synthetic Diesel
Sulfur @ 0.03% (300ppm) in Heavy Mineral Oil
Sulfur @ 0.03% (300ppm) in Light Mineral Oil
Sulfur @ 0.03% (300ppm) in Odourless Kerosene
Sulfur @ 0.05% (500ppm) in Heavy Mineral Oil
Sulfur @ 0.05% (500ppm) in Light Mineral Oil
Sulfur @ 0.05% (500ppm) in Odourless Kerosene
Sulfur @ 0.07% (700ppm) in Heavy Mineral Oil
Sulfur @ 0.07% (700ppm) in Light Mineral Oil
Sulfur @ 0.07% (700ppm) in Odourless Kerosene
Sulfur @ 0.075% (750ppm) in Synthetic Diesel
Sulfur @ 0.1% (1000ppm) in Heavy Mineral Oil
Sulfur @ 0.1% (1000ppm) in Light Mineral Oil
Sulfur @ 0.1% (1000ppm) in Odourless Kerosene
Sulfur @ 0.25% (2500ppm) in Synthetic Diesel
Sulfur @ 0.3% (3000ppm) in Heavy Mineral Oil
Sulfur @ 0.3% (3000ppm) in Light Mineral Oil
Sulfur @ 0.3% (3000ppm) in Odourless Kerosene
Sulfur @ 0.5% (5000ppm) in Heavy Mineral Oil
Sulfur @ 0.5% (5000ppm) in Light Mineral Oil
Sulfur @ 0.5% (5000ppm) in Odourless Kerosene
Sulfur @ 1% (10000ppm) in Heavy Mineral Oil
Sulfur @ 1% (10000ppm) in Light Mineral Oil
Sulfur @ 1.5% (15000ppm) in Synthetic Diesel
Sulfur @ 2% (20000ppm) in Heavy Mineral Oil
Sulfur @ 2% (20000ppm) in Light Mineral Oil
Sulfur @ 3% (30000ppm) in Heavy Mineral Oil
Sulfur @ 3% (30000ppm) in Light Mineral Oil
Sulfur @ 3500microg/g in Residual Oil, 100mL
Sulfur @ 4% (40000ppm) in Heavy Mineral Oil
Sulfur @ 4% (40000ppm) in Light Mineral Oil
Sulfur @ 5% (50000ppm) in Heavy Mineral Oil
Sulfur @ 5% (50000ppm) in Light Mineral Oil
Sulfur @ 7000microg/g in Residual Oil, 500mL
Sulfur Standard: S @ 250 microg/g in Isooctane
Q7636182
Sulfur - S @ 0ug/g in #2 Diesel Fuel, 1 gallon
Sulfur - S @ 0ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 1.00wt% in Residual Oil, 500mL
Sulfur - S @ 1000 microg/g in Heavy Mineral Oil
Sulfur - S @ 10ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 10ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 15ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 15ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 20ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 25ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 25ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 300ug/g in #2 Diesel Fuel, 50mL
Sulfur - S @ 5000microg/g in Residual Oil, 1L
Sulfur - S @ 500ug/g in #2 Diesel Fuel, 50mL
Sulfur - S @ 50ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 5ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 75ug/g in #2 Diesel Fuel, 500mL
Sulfur @ 0.0025% (25ppm) in Heavy Mineral Oil
Sulfur @ 0.0025% (25ppm) in Light Mineral Oil
Sulfur @ 0.0025% (25ppm) in Odourless Kerosene
Sulfur @ 0.025% (250ppm) in Heavy Mineral Oil
Sulfur @ 0.025% (250ppm) in Light Mineral Oil
Sulfur @ 0.025% (250ppm) in Odourless Kerosene
Sulfur @ 0.075% (750ppm) in Heavy Mineral Oil
Sulfur @ 0.075% (750ppm) in Light Mineral Oil
Sulfur @ 0.075% (750ppm) in Odourless Kerosene
Sulfur @ 0.25% (2500ppm) in Heavy Mineral Oil
Sulfur @ 0.25% (2500ppm) in Light Mineral Oil
Sulfur @ 0.25% (2500ppm) in Odourless Kerosene
Sulfur @ 1.5% (15000ppm) in Heavy Mineral Oil
Sulfur @ 1.5% (15000ppm) in Light Mineral Oil
Sulfur @ 1.5% (15000ppm) in Odourless Kerosene
ASTM D5453 Curve 1, S @ 0.5-10ppm in p-xylene
ASTM D5453 Curve 2, S @ 5-100 ppm in isooctane
ASTM D5453 Curve 2, S @ 5-100 ppm in p-xylene
PTP Sample for Sulfur in 20 cSt Mineral Oil Analysis
Q60998679
Sulfur - S @ 400ug/g in #2 Diesel Fuel, 250mL
Sulfur - S @ 1.00wt% in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 1.00wt% in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 1.00wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 1.0wt% in Light Mineral Oil, 500mL
Sulfur - S @ 100ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 100ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 10ug/g in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 10ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 15ug/g in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 15ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 2.00wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 200ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 200ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 20microg/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 20ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 25ug/g in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 25ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 3,500ug/g in Residual Oil, 500mL
Sulfur - S @ 300ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 4.00wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 400ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 400ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 5,000ug/g in Residual Oil, 1 Gallon
Sulfur - S @ 5.00wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 5000microg/g in #2 Diesel, 500mL
Sulfur - S @ 5000microg/g in Residual Oil, 500mL
Sulfur - S @ 500ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 500ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 500ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 50ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 750ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 750ug/g in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 750ug/g in #2 Diesel Fuel, 500mL
Sulfur - S @ 75microg/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 75ug/g in Light Mineral Oil, 500mL
Sulfur - S @0.050wt% in #2 Diesel Fuel, 1 Liter
Sulfur - S @0.300wt% in #2 Diesel Fuel, 1 Liter
Sulfur - S @0.500wt% in #2 Diesel Fuel, 1 Liter
Sulfur @ 500microg/g in #2 Diesel Fuel, 1/2Gallon
Sulfur Calibration Set: S @ 0-100 mg/kg in Toluene
Sulfur Calibration Set: S @ 0-50 mg/kg in Toluene
Sulfur Standard: S @ 10 microg/g in B100 Biodiesel
Sulfur Standard: S @ 15 microg/g in B100 Biodiesel
Sulfur Standard: S @ 20 microg/g in B100 Biodiesel
Sulfur Standard: S @ 25 microg/g in B100 Biodiesel
Sulfur Standard: S @ 5 microg/g in B100 Biodiesel
Sulfur Standard: S @ 50 microg/g in B100 Biodiesel
Sulfur, S @ 3000 ug/g in #2 Diesel Fuel, 1 Gal
ASTM D5453 Curve 1, S @ 0.5 -10ppm in isooctane
ASTM D5453 Curve 1, S @ 0.5 -10ppm in Toluene
ASTM D5453 Curve 2, S @ 5 -100 ppm in Toluene
Sulfur - S @ 2.00wt% in Light Mineral Oil, 500mL
Sulfur - S @ 3.00wt% in Light Mineral Oil, 500mL
Sulfur - S @ 4.00wt% in Light Mineral Oil, 500mL
Sulfur - S @ 0.100wt% in #2 Diesel Fuel, 1 Liter
Sulfur - S @ 0.100wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 0.300wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 0.750wt% in #2 Diesel Fuel, 500mL
Sulfur - S @ 1,000ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 1000ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 200microg/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 4000microg/g in 75 cSt Oil Heavy Oil
Sulfur - S @ 5,000ug/g in #2 Diesel Fuel, 1 Gal
Sulfur - S @ 5.00wt% in Light Mineral Oil, 500mL
Sulfur - S @ 5000ug/g in Light Mineral Oil, 500mL
Sulfur - S @ 5microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @0.0100wt% in #2 Diesel Fuel, 1 Liter
Sulfur Calibration Set: S @ 0-100 mg/kg in Isooctane
Sulfur Standard: S @ 100 microg/g in B100 Biodiesel
Sulfur Standard: S @ 500 microg/g in B100 Biodiesel
ASTM D5453 Curve 3, S @ 100 -1000 ppm in Toluene
ASTM D5453 Curve 3, S @ 100-1000 ppm in isooctane
ASTM D5453 Curve 3, S @ 100-1000 ppm in p-xylene
Sulfur - S @ 0.150wt% S in #2 Diesel Fuel, 500mL
Sulfur - S @ 100microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 10microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 15microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 20 microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 200 microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 250 microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 25microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 300 microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 50microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @ 75microg/g in 90% Isooctane/10% Ethanol
Sulfur - S @0.00050wt% in #2 Diesel Fuel, 1 Liter
F5FD384D-E823-4920-B313-6476A1F3F0C5
Polysulfide Oil Standard: 30,000 microg/g S in Mineral Oil
Polysulfide Oil Standard: 40,000 microg/g S in Mineral Oil
Sulfur - S @ 1500microg/g in Light Mineral Oil, 500mLs
Sulfur - S @ 3000microg/g in Light Mineral Oil, 500mLs
Sulfur - S @ 300microg/g in Light Mineral Oil, 500mLs
Sulfur - S @ 400microg/g in Light Mineral Oil, 500mLs
Sulfur - S @ 750microg/g in Light Mineral Oil, 500mLs
Sulfur - S @ 0 microg/g (blank) in #2 Diesel Fuel, 1 Liter
Sulfur Calibration Set: S @ 0-10 mg/Kg in Synthetic Diesel
Sulfur Calibration Set: S @ 0-25 mg/kg in Synthetic Diesel
Sulfur Standard: S @ 10 microg/g (0.0010 wt%) in Isooctane
Sulfur Standard: S @ 10 microg/g (0.0010 wt%) in Kerosene
Sulfur Standard: S @ 10 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 10 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 10 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 100 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 100 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 100 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 15 microg/g (0.0015 wt%) in Isooctane
Sulfur Standard: S @ 15 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 15 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 15 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 20 microg/g (0.0020 wt%) in Isooctane
Sulfur Standard: S @ 20 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 20 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 20 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 25 microg/g (0.0025 wt%) in Isooctane
Sulfur Standard: S @ 25 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 25 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 25 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 250 microg/g (0.0250 wt%) in Diesel
Sulfur Standard: S @ 250 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 2500 microg/g (0.2500 wt%) in Diesel
Sulfur Standard: S @ 5 microg/g (0.0005 wt%) in Isooctane
Sulfur Standard: S @ 5 microg/g (0.0005 wt%) in Kerosene
Sulfur Standard: S @ 5 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 5 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 5 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 50 microg/g (0.0050 wt%) in Isooctane
Sulfur Standard: S @ 50 microg/g (0.0050 wt%) in Kerosene
Sulfur Standard: S @ 50 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 50 ug/g in 75% Isooctane/25% Toluene
Sulfur Standard: S @ 50 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 500 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 500 ug/g in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 75 microg/g (0.0075 wt%) in Isooctane
Sulfur Standard: S @ 75 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 75 ug/g in 80% Isooctane/20% Toluene
IP 336, Sulfur Set D in Heavy Mineral Oil: S @ 2, 3, 4, 5 %
IP 336, Sulfur Set D in Light Mineral Oil: S @ 2, 3, 4, 5 %
IP 336, Sulfur Set D in Odourless Kerosene: S @ 2, 3, 4, 5 %
IP 336, Sulfur Set D in Synthetic Diesel: S @ 2, 3, 4, 5 %
Polysulfide Oil Standard: 100 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 15 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 20,000 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 250 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 300 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 50 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 5000 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: 750 microg/g S in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 1500 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 20 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 200 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 25 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 3000 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 400 microg/g in 13 cSt Mineral Oil
Polysulfide Oil Standard: S @ 75 microg/g in 13 cSt Mineral Oil
Sulfur Calibration Set: S @ 25-1000 mg/Kg in Synthetic Diesel
Sulfur Standard: S @ 100 microg/g (0.0100 wt%) in Isooctane
Sulfur Standard: S @ 100 microg/g (0.0100 wt%) in Kerosene
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in Isooctane
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in Kerosene
Sulfur Standard: S @ 1000 ug/g in 70% Isooctane/30% Toluene
Sulfur Standard: S @ 10000 microg/g (1.00 wt%) in Residual Oil
Sulfur Standard: S @ 200 microg/g (0.0200 wt%) in Isooctane
Sulfur Standard: S @ 20000 microg/g (2.00 wt%) in Residual Oil
Sulfur Standard: S @ 250 microg/g (0.0250 wt%) in Kerosene
Sulfur Standard: S @ 300 microg/g (0.0300 wt%) in Isooctane
Sulfur Standard: S @ 300 microg/g (0.0300 wt%) in Kerosene
Sulfur Standard: S @ 3000 microg/g (0.300 wt%) in Isooctane
Sulfur Standard: S @ 3000 microg/g (0.300 wt%) in Kerosene
Sulfur Standard: S @ 30000 microg/g (3.00 wt%) in Residual Oil
Sulfur Standard: S @ 400 microg/g (0.0400 wt%) in Isooctane
Sulfur Standard: S @ 40000 microg/g (4.00 wt%) in Residual Oil
Sulfur Standard: S @ 5 microg/g (0.0005 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 500 microg/g (0.0500 wt%) in Isooctane
Sulfur Standard: S @ 500 microg/g (0.0500 wt%) in Kerosene
Sulfur Standard: S @ 5000 microg/g (0.500 wt%) in Residual Oil
Sulfur Standard: S @ 50000 microg/g (5.00 wt%) in Residual Oil
Sulfur Standard: S @ 750 microg/g (0.0750 wt%) in Isooctane
Sulfur Standard: S @ 750 microg/g (0.0750 wt%) in Kerosene
Total Sulfur by UV Fluorescence Set for ASTM D5453 - in toluene
Total Sulfur by UV Fluorescence Set for ASTM D5453 -in toluene
ASTM D2622, Sulfur Set C in Heavy Mineral Oil: S @ 1, 2, 3, 4, 5 %
ASTM D2622, Sulfur Set C in Light Mineral Oil: S @ 1, 2, 3, 4, 5 %
ASTM D2622, Sulfur Set C in Odourless Kerosene: S @ 1, 2, 3, 4, 5 %
ASTM D2622, Sulfur Set C in Synthetic Diesel: S @ 1, 2, 3, 4, 5 %
ASTM D4294, Sulfur Set C in Heavy Mineral Oil: S @ 1, 2, 3, 4, 5 %
ASTM D4294, Sulfur Set C in Light Mineral Oil: S @ 1, 2, 3, 4, 5 %
ASTM D4294, Sulfur Set C in Odourless Kerosene: S @ 1, 2, 3, 4, 5 %
ASTM D4294, Sulfur Set C in Synthetic Diesel: S @ 1, 2, 3, 4, 5 %
ASTM D5453 Curve 1, S @ 0.5 -10ppm in 75% Isooctane/25% Toluene
ASTM D5453 Curve 2, S @ 5 -100 ppm in 75% Isooctane/25% Toluene
ASTM D5453 Curve 3, S @ 100 -1000 ppm in 75% Isooctane/25% Toluene
IP 336, Sulfur Set C in Heavy Mineral Oil: S @ 0.5, 1, 1.5, 2 %
IP 336, Sulfur Set C in Light Mineral Oil: S @ 0.5, 1, 1.5, 2 %
IP 336, Sulfur Set C in Odourless Kerosene: S @ 0.5, 1, 1.5, 2 %
IP 336, Sulfur Set C in Synthetic Diesel: S @ 0.5, 1, 1.5, 2 %
Mercaptan Sulphur in Hydrocarbons, Jet Aviation Fuel (Nominal: 15.2 mg/kg)
Sulfur Standard: S @ 10 microg/g (0.0010 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 10 microg/g (0.0010 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 10 microg/g (0.0010 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 100 microg/g (0.0100 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 100 microg/g (0.0100 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 100 microg/g (0.0100 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 1000 microg/g (0.100 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 1000 ug/g (0.1 wt%) in 80% Isooctane/20% Toluene
Sulfur Standard: S @ 10000 microg/g (1.00 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 10000 microg/g (1.00 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 10000 microg/g (1.00 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 15 microg/g (0.0015 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 15 microg/g (0.0015 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 15 microg/g (0.0015 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 1500 microg/g (0.150 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 1500 microg/g (0.150 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 1500 microg/g (0.150 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 20 microg/g (0.0020 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 20 microg/g (0.0020 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 20 microg/g (0.0020 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 200 microg/g (0.0200 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 200 microg/g (0.0200 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 200 microg/g (0.0200 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 20000 microg/g (2.00 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 20000 microg/g (2.00 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 20000 microg/g (2.00 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 25 microg/g (0.0025 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 25 microg/g (0.0025 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 25 microg/g (0.0025 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 250 microg/g (0.0250 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 250 microg/g (0.0250 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 250 microg/g in Isooctane (75%) & Toluene (25%)
Sulfur Standard: S @ 2500 microg/g (0.2500 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 2500 microg/g (0.2500 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 250microg/g in Isooctane (70%) and Toluene (30%)
Sulfur Standard: S @ 300 microg/g (0.0300 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 300 microg/g (0.0300 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 300 microg/g (0.0300 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 3000 microg/g (0.300 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 3000 microg/g (0.300 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 3000 microg/g (0.300 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 30000 microg/g (3.00 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 30000 microg/g (3.00 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 30000 microg/g (3.00 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 400 microg/g (0.0400 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 400 microg/g (0.0400 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 400 microg/g (0.0400 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 40000 microg/g (4.00 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 40000 microg/g (4.00 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 40000 microg/g (4.00 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 5 microg/g (0.0005 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 5 microg/g (0.0005 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 50 microg/g (0.0050 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 50 microg/g (0.0050 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 50 microg/g (0.0050 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 500 microg/g (0.0500 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 500 microg/g (0.0500 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 500 microg/g (0.0500 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 5000 microg/g (0.500 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 5000 microg/g (0.500 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 5000 microg/g (0.500 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 50000 microg/g (5.00 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 50000 microg/g (5.00 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 50000 microg/g (5.00 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 7 microg/g (0.0007 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 700 microg/g (0.0700 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 700 microg/g (0.0700 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 75 microg/g (0.0075 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 75 microg/g (0.0075 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 75 microg/g (0.0075 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 750 microg/g (0.0750 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 750 microg/g (0.0750 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 750 microg/g (0.0750 wt%) in 75 cSt Mineral Oil
Sulfur Standard: S @ 7500 microg/g (0.750 wt%) in #2 Diesel Fuel
Sulfur Standard: S @ 7500 microg/g (0.750 wt%) in 75 cSt Mineral Oil
"ASTM D4294, Sulfur Set B in Diesel: S @ 1000, 2500, 5000, 10000 microg/g"
"ASTM D7220, Sulfur Set A in Diesel: S @ 0, 5, 10, 25, 50 microg/g"
"ASTM D7220, Sulfur Set A in Light Oil (20 cSt): S @ 0, 5, 10, 25, 50 microg/g"
"IP 336, Sulfur Set B in Light Oil (20 cSt): S @ 0, 1000, 3000, 5000 microg/g"
ASTM D2622, Sulfur Set B in Heavy Mineral Oil: S @ 0.1, 0.25, 0.5, 1 %
ASTM D2622, Sulfur Set B in Light Mineral Oil: S @ 0.1, 0.25, 0.5, 1 %
ASTM D2622, Sulfur Set B in Odourless Kerosene: S @ 0.1, 0.25, 0.5, 1 %
ASTM D2622, Sulfur Set B in Synthetic Diesel: S @ 0.1, 0.25, 0.5, 1 %
ASTM D4294, Sulfur Set B in Heavy Mineral Oil: S @ 0.1, 0.25, 0.5, 1 %
ASTM D4294, Sulfur Set B in Light Mineral Oil: S @ 0.1, 0.25, 0.5, 1 %
ASTM D4294, Sulfur Set B in Odourless Kerosene: S @ 0.1, 0.25, 0.5, 1 %
ASTM D4294, Sulfur Set B in Synthetic Diesel: S @ 0.1, 0.25, 0.5, 1 %
IP 336, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.03, 0.05, 0.07, 0.1 %
IP 336, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.03, 0.05, 0.07, 0.1 %
IP 336, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.03, 0.05, 0.07, 0.1 %
IP 336, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.03, 0.05, 0.07, 0.1 %
IP 336, Sulfur Set B in Heavy Mineral Oil: S @ Blank, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set B in Light Mineral Oil: S @ Blank, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set B in Odourless Kerosene: S @ Blank, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set B in Synthetic Diesel: S @ Blank, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set F in Heavy Mineral Oil: S @ 0.5, 1, 1.5, 2, 3, 4, 5 %
IP 336, Sulfur Set F in Light Mineral Oil: S @ 0.5, 1, 1.5, 2, 3, 4, 5 %
IP 336, Sulfur Set F in Odourless Kerosene: S @ 0.5, 1, 1.5, 2, 3, 4, 5 %
IP 336, Sulfur Set F in Synthetic Diesel: S @ 0.5, 1, 1.5, 2, 3, 4, 5 %
Sulfur Set for ASTM D5453 - S @ 0, 1, 2.5, 5, 7.5, 10 ng/microL in toluene.
Sulfur Set for ASTM D5453 - S @ 0, 100, 250, 500, 750, 1000 ng/microL in Toluene
Sulfur Set for ASTM D5453: S @ 0, 1.0, 2.5, 5, 7.5, 10 ng/microL in Isooctane
Sulfur Set for ASTM D5453: S @ 0, 100, 250, 500, 750, 1000 ng/microL in Isooctane
Sulfur Set for ASTM D5453: S @ 0, 2.5, 5, 7.5, 15, 20 ng/microL in p-xylene
Sulfur Set for ASTM D5453: S @ 0, 5, 25, 50, 100, 200 ng/microL in Isooctane
Sulfur Standard: S @ 15000 microg/g (1.5000 wt%) in 20 cSt Mineral Oil
Sulfur Standard: S @ 15000 microg/g (1.5000 wt%) in 75 cSt Mineral Oil
"ASTM D2622, Sulfur Set A in Diesel: S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D2622, Sulfur Set A in Heavy Oil (75 cSt): S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D2622, Sulfur Set A in Light Oil (20 cSt): S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D2622, Sulfur Set B in Heavy Oil (75 cSt): S @ 1000, 2500, 5000, 10000 microg/g"
"ASTM D2622, Sulfur Set B in Light Oil (20 cSt): S @ 1000, 2500, 5000, 10000 microg/g"
"ASTM D2622, Sulfur Set C in Diesel: S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"ASTM D2622, Sulfur Set C in Heavy Oil (75 cSt): S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"ASTM D2622, Sulfur Set C in Light Oil (20 cSt): S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"ASTM D4294, Sulfur Set A in Diesel: S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D4294, Sulfur Set A in Heavy Oil (75 cSt): S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D4294, Sulfur Set A in Kerosene: S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D4294, Sulfur Set A in Light Oil (20 cSt): S @ 0, 5, 10, 100, 250, 500, 750, 1000 microg/g"
"ASTM D4294, Sulfur Set B in Heavy Oil (75 cSt): S @ 1000, 2500, 5000, 10000 microg/g"
"ASTM D4294, Sulfur Set B in Light Oil (20 cSt): S @ 1000, 2500, 5000, 10000 microg/g"
"ASTM D4294, Sulfur Set C in Diesel: S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"ASTM D4294, Sulfur Set C in Heavy Oil (75 cSt): S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"ASTM D4294, Sulfur Set C in Light Oil (20 cSt): S @ 10000, 20000, 30000, 40000, 50000 microg/g"
"IP 336, Sulfur Set A in Light Oil (20 cSt): S @ 0, 300, 500, 700, 1000 microg/g"
"IP 336, Sulfur Set C in Light Oil (20 cSt): S @ 5000, 10000, 15000, 20000 microg/g"
"IP 336, Sulfur Set D in Light Oil (20 cSt): S @ 20000, 30000, 40000, 50000 microg/g"
"IP 336, Sulfur Set E in Heavy Oil (75 cSt): S @ 0, 300, 500, 700, 1000, 3000, 5000 microg/g"
"IP 336, Sulfur Set E in Light Oil (20 cSt): S @ 0, 300, 500, 700, 1000, 3000, 5000 microg/g"
"IP 336, Sulfur Set F in Heavy Oil (75 cSt): S @ 5000, 10000, 15000, 20000, 30000, 40000, 50000 microg/g"
"IP 336, Sulfur Set F in Light Oil (20 cSt): S @ 5000, 10000, 15000, 20000, 30000, 40000, 50000 microg/g"
ASTM D2622, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D2622, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D2622, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D2622, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D4294, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D4294, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D4294, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D4294, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.0005, 0.001, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D7039, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.0005, 0.005, 0.025, 0.05 %
ASTM D7039, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.0005, 0.005, 0.025, 0.05 %
ASTM D7039, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.0005, 0.005, 0.025, 0.05 %
ASTM D7039, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.0005, 0.005, 0.025, 0.05 %
ASTM D7039, Sulfur Set B in Heavy Mineral Oil: S @ Blank, 0.0025, 0.01, 0.05, 0.1, 0.3 %
ASTM D7039, Sulfur Set B in Light Mineral Oil: S @ Blank, 0.0025, 0.01, 0.05, 0.1, 0.3 %
ASTM D7039, Sulfur Set B in Odourless Kerosene: S @ Blank, 0.0025, 0.01, 0.05, 0.1, 0.3 %
ASTM D7039, Sulfur Set B in Synthetic Diesel: S @ Blank, 0.0025, 0.01, 0.05, 0.1, 0.3 %
ASTM D7220, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.0005, 0.001, 0.0025, 0.005 %
ASTM D7220, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.0005, 0.001, 0.0025, 0.005 %
ASTM D7220, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.0005, 0.001, 0.0025, 0.005 %
ASTM D7220, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.0005, 0.001, 0.0025, 0.005 %
ASTM D7220, Sulfur Set B in Heavy Mineral Oil: S @ 0.005, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D7220, Sulfur Set B in Light Mineral Oil: S @ 0.005, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D7220, Sulfur Set B in Odourless Kerosene: S @ 0.005, 0.01, 0.025, 0.05, 0.075, 0.1 %
ASTM D7220, Sulfur Set B in Synthetic Diesel: S @ 0.005, 0.01, 0.025, 0.05, 0.075, 0.1 %
IP 336, Sulfur Set E in Heavy Mineral Oil: S @ Blank, 0.03, 0.05, 0.07, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set E in Light Mineral Oil: S @ Blank, 0.03, 0.05, 0.07, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set E in Odourless Kerosene: S @ Blank, 0.03, 0.05, 0.07, 0.1, 0.3, 0.5 %
IP 336, Sulfur Set E in Synthetic Diesel: S @ Blank, 0.03, 0.05, 0.07, 0.1, 0.3, 0.5 %
IP 496, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.01, 0.03, 0.05, 0.07, 0.1 %
IP 496, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.01, 0.03, 0.05, 0.07, 0.1 %
IP 496, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.01, 0.03, 0.05, 0.07, 0.1 %
IP 496, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.01, 0.03, 0.05, 0.07, 0.1 %
IP 497, Sulfur Set A in Heavy Mineral Oil: S @ Blank, 0.005, 0.01, 0.025, 0.03, 0.05 %
IP 497, Sulfur Set A in Light Mineral Oil: S @ Blank, 0.005, 0.01, 0.025, 0.03, 0.05 %
IP 497, Sulfur Set A in Odourless Kerosene: S @ Blank, 0.005, 0.01, 0.025, 0.03, 0.05 %
IP 497, Sulfur Set A in Synthetic Diesel: S @ Blank, 0.005, 0.01, 0.025, 0.03, 0.05 %
Mercaptan Sulfur Set for UOP 163 and ASTM D3227: S @ 10 microg/g in 80% Isooctane/20% Toluene
Sulfur Set for ASTM D4045: S @ 0, 0.1, 0.5, 1.0, 2.5, 5.0, 10 microg/g in Isooctane
Total Sulfur by UV Fluorescence Set for ASTM D5453 - S @ 0, 1, 2.5, 5, 7.5, 10 ng/microL. Set of 6x2mL ampoules in toluene.
Microorganism:

Yes

IUPAC namesulfane
SMILESS
InchiInChI=1S/H2S/h1H2
FormulaH2S
PubChem ID402
Molweight34.08
LogP0.5
Atoms1
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationsulfur compounds thioethers sulfides
CHEBI-ID16136
Supernatural-IDSN0337276

mVOC Specific Details

Boiling Point
DegreeReference
60.33 °C peer reviewed
Volatilization
The Henry's Law constant for hydrogen sulfide has been measured as 0.0098 atm-cu m/mole at 25 °C(1). This Henry's Law constant indicates that hydrogen sulfide is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 1.8 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 2.3 days(SRC). Hydrogen sulfide is a weak base and has two pKa values of pKa1 = 7.04 and pKa2 = 11.96(3) which indicate some dissociation at environmental pHs(4). At pH 5-6, the water-air transfer rate was found to behave like an unreactive gas, but as the pH increases to pH10, the transfer rate was enhanced and nearly 200 times faster at pH10 than pH 5(4). Hydrogen sulfide's Henry's Law constant indicates that volatilization from moist soil surfaces will occur(SRC). Hydrogen sulfide is a gas at ambient temperatures(3) and expected to volatilize from dry soil surfaces(SRC); however, hydrogen sulfide gas can adsorb to both moist and dry soil surfaces(5) which may attenuate the rate of volatilization(SRC).
Soil Adsorption
Hydrogen sulfide gas was found to absorb rapidly to six different soil types(1). For example, when hydrogen sulfide gas was passed over six air-dried and moist (50% field capacity) soils, 15.4-65.2 mg/g and 11.0-65.2 mg/g of hydrogen sulfide rapidly adsorbed to the dry and moist soils, respectively(1). Neither the capacity or rate of sorption was correlated to soil pH, organic matter content, or clay content; sterile controls ruled out the involvement of microorganisms(1); it was suggested that adsorption to soil surfaces might be an environmental sink for gaseous hydrogen sulfide(1).

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEnterococcus FaecalisNANAThorn et al. 2011
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAScotter et al. 2006
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaNeisseria MeningitidisNANAScotter et al. 2006
ProkaryotaProteus MirabilisNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAThorn et al. 2011
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaStreptococcus PneumoniaeNANAScotter et al. 2006
ProkaryotaMycobacterium BovisNANAMcNerney et al. 2012
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaEnterococcus FaecalisTYESIFT-MSno
ProkaryotaEscherichia Colihuman bloodSIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaNeisseria Meningitidishuman bloodSIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas Aeruginosahuman bloodSIFT-MSno
ProkaryotaPseudomonas AeruginosaBacT/ALERT FASIFT-MSno
ProkaryotaPseudomonas AeruginosaTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaStaphylococcus Aureushuman bloodSIFT-MSno
ProkaryotaStaphylococcus AureusBacT/ALERT FASIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStreptococcus Pneumoniaehuman bloodSIFT-MSno
ProkaryotaMycobacterium BovisLG + glycerolTD/GC-MS and SIFT-MSno


Acetic Acid

Mass-Spectra

Compound Details

Synonymous names
acetic acid
ethanoic acid
64-19-7
Acetic acid glacial
Ethylic acid
Vinegar acid
Glacial acetic acid
Acetic acid, glacial
Methanecarboxylic acid
Acetasol
Essigsaeure
Acide acetique
Pyroligneous acid
Vinegar
Azijnzuur
Aceticum acidum
Acido acetico
Octowy kwas
Aci-jel
HOAc
ethoic acid
Kyselina octova
Orthoacetic acid
AcOH
Azijnzuur [Dutch]
Ethanoic acid monomer
Acetic
Essigsaeure [German]
Caswell No. 003
Otic Tridesilon
Octowy kwas [Polish]
Acetic acid (natural)
Acide acetique [French]
Acido acetico [Italian]
FEMA No. 2006
Kyselina octova [Czech]
MeCOOH
Acetic acid-17O2
Otic Domeboro
Acidum aceticum glaciale
Acidum aceticum
CH3-COOH
acetic acid-
CH3CO2H
UN2789
UN2790
EPA Pesticide Chemical Code 044001
NSC 132953
NSC-132953
NSC-406306
BRN 0506007
Acetic acid, diluted
INS NO.260
Acetic acid [JAN]
DTXSID5024394
MeCO2H
CHEBI:15366
AI3-02394
CH3COOH
INS-260
Q40Q9N063P
E-260
10.Methanecarboxylic acid
CHEMBL539
NSC-111201
NSC-112209
NSC-115870
NSC-127175
Acetic acid-2-13C,d4
INS No. 260
DTXCID304394
E 260
Acetic-13C2 acid (8CI,9CI)
Ethanoat
Shotgun
MFCD00036152
Acetic acid, of a concentration of more than 10 per cent, by weight, of acetic acid
285977-76-6
68475-71-8
C2:0
acetyl alcohol
Orlex
Vosol
ACETIC-1-13C-2-D3 ACID-1 H (D)
WLN: QV1
ACETIC ACID (MART.)
ACETIC ACID [MART.]
Acetic acid, >=99.7%
57745-60-5
63459-47-2
FEMA Number 2006
ACETIC-13C2-2-D3 ACID, 97 ATOM % 13C, 97 ATOM % D
Acetic acid, ACS reagent, >=99.7%
ACY
HSDB 40
CCRIS 5952
79562-15-5
methane carboxylic acid
EINECS 200-580-7
Acetic acid 0.25% in plastic container
Essigsaure
Ethylate
acetic aicd
acetic-acid
Glacial acetate
acetic cid
actic acid
UNII-Q40Q9N063P
acetic -acid
Distilled vinegar
Methanecarboxylate
Acetic acid, glacial [USP:JAN]
Acetasol (TN)
Acetic acid,glacial
Carboxymethyl radical
for LC-MS
Vinegar (Salt/Mix)
HOOCCH3
546-67-8
Acetic acid LC/MS Grade
ACETIC ACID [II]
ACETIC ACID [MI]
Acetic acid, ACS reagent
bmse000191
bmse000817
bmse000857
Otic Domeboro (Salt/Mix)
EC 200-580-7
Acetic acid (JP17/NF)
ACETIC ACID [FHFI]
ACETIC ACID [INCI]
Acetic Acid [for LC-MS]
ACETIC ACID [VANDF]
NCIOpen2_000659
NCIOpen2_000682
Acetic acid, glacial (USP)
4-02-00-00094 (Beilstein Handbook Reference)
77671-22-8
Glacial acetic acid (JP17)
UN 2790 (Salt/Mix)
ACETIC ACID [WHO-DD]
ACETIC ACID [WHO-IP]
ACETICUM ACIDUM [HPUS]
GTPL1058
Acetic Acid Glacial HPLC Grade
Acetic acid, analytical standard
Acetic acid, Glacial USP grade
Acetic acid, puriss., >=80%
Acetic acid, 99.8%, anhydrous
Acetic acid, AR, >=99.8%
Acetic acid, LR, >=99.5%
DTXSID001043500
Acetic acid, extra pure, 99.8%
Acetic acid, 99.5-100.0%
Acetic acid, Glacial, ACS Reagent
STR00276
Acetic acid, puriss., 99-100%
Tox21_301453
Acetic acid, glacial, >=99.85%
BDBM50074329
FA 2:0
LMFA01010002
NSC132953
NSC406306
STL264240
Acetic acid, for HPLC, >=99.8%
AKOS000268789
ACIDUM ACETICUM [WHO-IP LATIN]
DB03166
MCULE-8295936189
UN 2789
Acetic acid, >=99.5%, FCC, FG
Acetic acid, natural, >=99.5%, FG
Acetic acid, ReagentPlus(R), >=99%
CAS-64-19-7
USEPA/OPP Pesticide Code: 044001
Acetic acid, USP, 99.5-100.5%
NCGC00255303-01
Acetic acid 1000 microg/mL in Methanol
Acetic acid, SAJ first grade, >=99.0%
DB-085748
Acetic acid 1000 microg/mL in Acetonitrile
Acetic acid, >=99.99% trace metals basis
Acetic acid, JIS special grade, >=99.7%
Acetic acid, purified by double-distillation
NS00002089
Acetic acid, UV HPLC spectroscopic, 99.9%
EN300-18074
Acetic acid, Vetec(TM) reagent grade, >=99%
Bifido Selective Supplement B, for microbiology
C00033
D00010
ORLEX HC COMPONENT ACETIC ACID, GLACIAL
Q47512
VOSOL HC COMPONENT ACETIC ACID, GLACIAL
Acetic acid, glacial, electronic grade, 99.7%
TRIDESILON COMPONENT ACETIC ACID, GLACIAL
A834671
ACETASOL HC COMPONENT ACETIC ACID, GLACIAL
Acetic acid, >=99.7%, SAJ super special grade
ACETIC ACID, GLACIAL COMPONENT OF BOROFAIR
ACETIC ACID, GLACIAL COMPONENT OF ORLEX HC
ACETIC ACID, GLACIAL COMPONENT OF VOSOL HC
SR-01000944354
ACETIC ACID, GLACIAL COMPONENT OF TRIDESILON
SR-01000944354-1
ACETIC ACID, GLACIAL COMPONENT OF ACETASOL HC
Glacial acetic acid, meets USP testing specifications
InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4
Acetic acid, >=99.7%, suitable for amino acid analysis
Acetic acid, >=99.7%, for titration in non-aqueous medium
Acetic acid, for luminescence, BioUltra, >=99.5% (GC)
Acetic acid, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.8%
Acetic acid, semiconductor grade MOS PURANAL(TM) (Honeywell 17926)
Glacial acetic acid, United States Pharmacopeia (USP) Reference Standard
Acetic acid, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.8%
Glacial Acetic Acid, Pharmaceutical Secondary Standard; Certified Reference Material
158461-04-2
2887-46-9
Acetic acid, puriss., meets analytical specification of Ph. Eur., BP, USP, FCC, 99.8-100.5%
Microorganism:

Yes

IUPAC nameacetic acid
SMILESCC(=O)O
InchiInChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
FormulaC2H4O2
PubChem ID176
Molweight60.05
LogP-0.2
Atoms4
Bonds0
H-bond Acceptor2
H-bond Donor1
Chemical Classificationacids organic acids
CHEBI-ID15366
Supernatural-IDSN0314461

mVOC Specific Details

Boiling Point
DegreeReference
117.9 °C peer reviewed
Volatilization
The Henry's Law constant for acetic acid has been experimentally determined to be 1.43X10-7 atm-cu m/mole at 25 deg C(1). This Henry's Law constant indicates that acetic acid is expected to be essentially nonvolatile from water surfaces(2). Acetic acid's Henry's Law constant indicates that volatilization from moist soil surfaces is not expected to be an important fate process(SRC). Acetic acid is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 15.7 mm Hg at 25 deg C(3).
Literature: (1) Johnson BJ et al; J Atmos Chem 24: 113-119 (1996) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng. New York, NY: Hemisphere Pub Corp (1989)
Soil Adsorption
A log Koc of 0.00 (Koc = 1), which was derived from experimental measurements, has been reported for acetic acid(1,2). According to a classification scheme(3), this Koc value suggests that acetic acid is expected to have very high mobility in soil. No detectable sorption was measured for acetic acid using the OECD Guideline 106 method employing an acidic forest soil, pH 2.8, an agricultural soil, pH 6.7, and a lake sediment, pH 7.1(4). Adsorption of acetic acid to 3 nearshore marine sediments collected from three different locations resulted in Kd values of 0.65 (Koc = 228), 0.085 (Koc = 6.5) and 0.046 (Koc = 27) using clastic mud (3.5% organic carbon, pH 7.0), muddy sand (1.3% organic carbon, pH 7.7), and carbonate sand (0.17% organic carbon, pH 8.1), respectively(5). The pKa of acetic acid is 4.76(6), indicating that this compound will exist partially in anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(7).
Literature: (1) Schuurmann G et al; Environ Sci Technol 40: 7005-7011 (Supplemental material) (2006) (2) Meylan WM et al; Environ Sci Technol 26: 1560-7 (1992) (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Von Oepen B et al; Chemosphere 22: 285-304 (1991) (5) Sansone JF et al; Geochimica et Cosmochimica Acta 51: 1889-1896 (1987) (6) Serjeant EP, Dempsey B; Ionisation Constants of Organic Acids in Aqueous Solution. IUPAC Chemical Data Series No. 23. New York, NY: Pergamon Press, p. 989 (1979) (7) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Literature: #In 24 hr aqueous adsorption studies using montmorillonite and kaolinite clay adsorbents, 2.4-30.4% of added acetic acid was observed to be in the adsorbed phase(1). In adsorption studies using the adsorbent hydroxyapatite (a mineral which occurs in the environment as a result of the diagenesis of skeletal apatite), only 5% of added acetic acid (in aqueous solution, pH 8.0) became adsorbed to the hydroxyapatite(2). Acetic acid has been noted to leach from biological disposal areas(3).
Literature: (1) Hemphill L, Swanson WS; Proc of the 18th Industrial Waste Conf, Eng Bull Purdue Univ, Lafayette IN 18: 204-17 (1964) (2) Gordon AS, Millero FJ; Microb Ecol 11: 289-98 (1985) (3) Abrams EF et al; Identification of Organic Compounds in Effluents from Industrial Sources. USEPA-560/3-75-002 p. 3 (1975)
Vapor Pressure
PressureReference
15.7 mm Hg at 25 deg C /Extrapolated/Daubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
MS-MS Spectrum 2640 - LC-ESI-QQ (API3000, Applied Biosystems) 50V Negative
MS-MS Spectrum 2637 - LC-ESI-QQ (API3000, Applied Biosystems) 20V Negative
MS-MS Spectrum 2638 - LC-ESI-QQ (API3000, Applied Biosystems) 30V Negative
MS-MS Spectrum 179743
MS-MS Spectrum 182077
MS-MS Spectrum 182078
MS-MS Spectrum 71 - Quattro_QQQ 40V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 179744
MS-MS Spectrum 70 - Quattro_QQQ 25V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 2636 - LC-ESI-QQ (API3000, Applied Biosystems) 10V Negative
MS-MS Spectrum 179742
MS-MS Spectrum 69 - Quattro_QQQ 10V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 182076
MS-MS Spectrum 2635 - EI-B (HITACHI M-80B) Positive
MS-MS Spectrum 2639 - LC-ESI-QQ (API3000, Applied Biosystems) 40V Negative
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANAZhu et al. 2010
ProkaryotaStaphylococcus AureusNANAZhu et al. 2010
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaNeisseria MeningitidisNANAAllardyce et al. 2006
ProkaryotaNeisseria MeningitidisNANAScotter et al. 2006
ProkaryotaProteus MirabilisNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANAAllardyce et al. 2006
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANAAllardyce et al. 2006
ProkaryotaStaphylococcus AureusNANAThorn et al. 2011
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PneumoniaeNANAAllardyce et al. 2006
ProkaryotaEscherichia ColiNANAFitzgerald et al. 2021
ProkaryotaStaphylococcus AureusNANAFitzgerald et al. 2021
ProkaryotaKlebsiella PneumoniaeNANARees et al. 2016a
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
EukaryotaAspergillus FumigatusNANABazemore et al. 2012
ProkaryotaEscherichia ColiNANABoots et al. 2014
ProkaryotaHaemophilus InfluenzaeNANAFilipiak et al. 2012
ProkaryotaStaphylococcus AureusNANAFilipiak et al. 2012
ProkaryotaStreptococcus PneumoniaeNANAFilipiak et al. 2012
ProkaryotaStaphylococcus EpidermidisNATimm et al. 2018
EukaryotaTrichoderma Harzianum0NALi et al. 2018
EukaryotaTrichoderma Virens0NALi et al. 2018
EukaryotaTrichoderma HarzianumNALi et al. 2018
EukaryotaTrichoderma VirensNALi et al. 2018
ProkaryotaPseudomonas Sp.antifungal activity against Thielaviopsis ethacetica mycelial growthBrazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; BrazilFreitas et al. 2022
ProkaryotaArthrobacter Nicotinovoransstimulate growth in Arabidopsis thaliana seedlings depending on inoculum concentrationavocado trees (Persea americana) rhizosphereGamboa-Becerra et al. 2022
ProkaryotaErwinia Persicinaavocado trees (Persea americana) rhizosphereGamboa-Becerra et al. 2022
ProkaryotaStaphylococcus AureusLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaEscherichia ColiLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaStaphylococcus Epidermidisstrains were provided by Prof. O'Gara at NUI GalwayFitzgerald et al. 2020
EukaryotaMortierella Alpina/globalpinaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Angustaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Bainieriisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaLinnemannia Exiguaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaLinnemannia Gamsiiisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Gemmiferaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaPodila Horticolaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaPodila Humilis/verticilataisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaLinnemannia Hyalinaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaEntomortierella Parvisporaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Pseudozygosporaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Solitariaisolate from different types of soil in AustriaTelagathoti et al. 2021
EukaryotaMortierella Zonataisolate from different types of soil in AustriaTelagathoti et al. 2021
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaBacillus VelezensisNARiu et al. 2022
ProkaryotaEscherichia ColiSwedish Institute for Communicable Disease Control (SMI), Stockholm, SwedenSousa et al. 2023
ProkaryotaBacillus Subtilispromote biomass production of Arabidopsis thalianarhizosphere of Haloxylon ammodendronHe et al. 2023
ProkaryotaBurkholderia Tropican/aNATenorio-Salgado et al. 2013
ProkaryotaBacillus Sp.Highly attractive to Mexican fruit flies.NASchulz and Dickschat 2007
ProkaryotaStaphylococcus Sp.Highly attractive to Mexican fruit flies.NASchulz and Dickschat 2007
ProkaryotaClostridium Sp.n/aNAStotzky and Schenck 1976
ProkaryotaVeillonella Sp.Reduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.NAHinton and Hume 1995
ProkaryotaBacteroides FragilisReduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.NAHinton and Hume 1995
EukaryotaPenicillium Aurantiogriseumn/aNABörjesson et al. 1990
ProkaryotaBacteroides Biviusn/aNAWiggins et al. 1985
ProkaryotaBacteroides Distasonisn/aNAWiggins et al. 1985
ProkaryotaBacteroides Ovatusn/aNAWiggins et al. 1985
ProkaryotaBacteroides Thetaiotaomicronn/aNAWiggins et al. 1985
ProkaryotaBacteroides Vulgatusn/aNAWiggins et al. 1985
ProkaryotaClostridium Cadaverumn/aNAWiggins et al. 1985
ProkaryotaClostridium Histolyticumn/aNAWiggins et al. 1985
ProkaryotaClostridium Tertiumn/aNAWiggins et al. 1985
ProkaryotaClostridium Bifermentansn/aNAWiggins et al. 1985
ProkaryotaClostridium Fallaxn/aNAWiggins et al. 1985
ProkaryotaClostridium Butyricumn/aNAWiggins et al. 1985
ProkaryotaClostridium Sporogenesn/aNAWiggins et al. 1985
ProkaryotaLactobacillus Casein/aNATracey and Britz 1989
ProkaryotaLactobacillus Plantarumn/aNATracey and Britz 1989
ProkaryotaPediococcus Damnosusn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Cremorisn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Dextranicumn/aNATracey and Britz 1989
ProkaryotaLactococcus Lactisn/aNATracey and Britz 1989
ProkaryotaOenococcus Oenin/aNATracey and Britz 1989
ProkaryotaPorphyromonas Gingivalisn/aNAKurita-Ochiai et al. 1995
ProkaryotaPrevotella Loescheiin/aNAKurita-Ochiai et al. 1995
ProkaryotaPrevotella Intermedian/aNAKurita-Ochiai et al. 1995
ProkaryotaFusobacterium Nucleatumn/aNAKurita-Ochiai et al. 1995
ProkaryotaActinobacillus Actinomycetemcomitansn/aNAKurita-Ochiai et al. 1995
ProkaryotaCapnocytophaga Ochracean/aNAKurita-Ochiai et al. 1995
ProkaryotaEscherichia Colin/aNABunge et al. 2008
ProkaryotaShigella Flexnerin/aNABunge et al. 2008
ProkaryotaSalmonella Enterican/aNABunge et al. 2008
EukaryotaCandida Tropicalisn/aNABunge et al. 2008
ProkaryotaSerratia Sp.n/aNABruce et al. 2004
EukaryotaSaccharomyces Cerevisiaen/aNABruce et al. 2004
EukaryotaTuber Excavatumn/aFortywoodland of the Basilicata regionMauriello et al. 2004
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaMuscodor Albusn/aNACorcuff et al. 2011
ProkaryotaKlebsiella Pneumoniaen/aNAJulak et al. 2003
ProkaryotaStaphylococcus Aureusn/aNAJulak et al. 2003
ProkaryotaAzospirillum Brasilensepromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
ProkaryotaBacillus Pumiluspromotion of performance of Chlorella sorokiniana ShihNAAmavizca et al. 2017
ProkaryotaAcinetobacter Baumanniiclinical exudatesJulak et al. 2003
ProkaryotaActinomyces Europaeusclinical exudatesJulak et al. 2003
ProkaryotaActinomyces Naeslundiiclinical exudatesJulak et al. 2003
ProkaryotaBacteroides Capillosusclinical exudatesJulak et al. 2003
ProkaryotaBacteroides Pyogenesclinical exudatesJulak et al. 2003
ProkaryotaClostridium Difficileclinical exudatesJulak et al. 2003
ProkaryotaClostridium Perfringensclinical exudatesJulak et al. 2003
ProkaryotaClostridium Ramosumclinical exudatesJulak et al. 2003
ProkaryotaClostridium Septicumclinical exudatesJulak et al. 2003
ProkaryotaEnterococcus Faecalisclinical exudatesJulak et al. 2003
ProkaryotaEubacterium Lentumclinical exudatesJulak et al. 2003
ProkaryotaFusobacterium Simiaeclinical exudatesJulak et al. 2003
ProkaryotaFusobacterium Necrophorumclinical exudatesJulak et al. 2003
ProkaryotaLactobacillus Acidophilusclinical exudatesJulak et al. 2003
ProkaryotaNocardia Sp.clinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Anaerobiusclinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Asaccharolyticusclinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Prevotiiclinical exudatesJulak et al. 2003
ProkaryotaPropionibacterium Acnesclinical exudatesJulak et al. 2003
ProkaryotaPropionibacterium Propionicumclinical exudatesJulak et al. 2003
ProkaryotaProteus Mirabilisclinical exudatesJulak et al. 2003
ProkaryotaStaphylococcus Epidermidisclinical exudatesJulak et al. 2003
ProkaryotaStreptococcus Agalactiaeclinical exudatesJulak et al. 2003
ProkaryotaStreptococcus Pyogenesclinical exudatesJulak et al. 2003
ProkaryotaStreptococcus Viridansclinical exudatesJulak et al. 2003
EukaryotaCandida Albicansclinical exudatesJulak et al. 2003
ProkaryotaStreptococcus Uberismilk of cowsHettinga et al. 2008
ProkaryotaStreptococcus Dysgalactiaemilk of cowsHettinga et al. 2008
ProkaryotaStreptococcus PneumoniaeclinicPreti et al. 2009
ProkaryotaHaemophilus InfluenzaeclinicPreti et al. 2009
EukaryotaSaccharomyces Cerevisiaegrape vineBecher et al. 2012
EukaryotaPenicillium CamembertiNALarsen 1998
EukaryotaPenicillium CaseifulvumNALarsen 1998
ProkaryotaArthrobacter Agilisnarhizosphere of maize plantsVelázquez-Becerra et al. 2011
ProkaryotaPseudomonas Brassicacearumreduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al. 2015
ProkaryotaPseudomonas Simiaenarhizosphere of a soybean field in the province of Rajasthan, IndiaVaishnav et al. 2016
ProkaryotaLactobacillus RhamnosusnaDomiati cheesePogačić et al. 2016
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
ProkaryotaSerratia Sp.NANAAlmeida et al. 2022
EukaryotaAureobasidium PullulansNANAMozūraitis et al. 2022
EukaryotaCryptococcus WieringaeNANAMozūraitis et al. 2022
EukaryotaHanseniaspora UvarumNANAMozūraitis et al. 2022
EukaryotaPichia KudriavzeviiNANAMozūraitis et al. 2022
EukaryotaPichia FermentansNANAMozūraitis et al. 2022
EukaryotaPichia MembranifaciensNANAMozūraitis et al. 2022
EukaryotaSaccharomyces ParadoxusNANAMozūraitis et al. 2022
EukaryotaTorulaspora DelbrueckiiNANAMozūraitis et al. 2022
EukaryotaPichia AnomalaNANAMozūraitis et al. 2022
EukaryotaMetschnikowia PulcherrimaNANAMozūraitis et al. 2022
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
EukaryotaWickerhamomyces AnomalusNANAShi et al. 2022
ProkaryotaBacillus SubtilisNANALee et al. 2023
ProkaryotaAcetobacter IndonesiensisNANATran et al. 2022
Lentinula EdodesGeng et al. 2024
Lactiplantibacillus PlantarumChen et al. 2023
Lactobacillus PlantarumZhang et al. 2023
Bacillus ThuringiensisKoilybayeva et al. 2023
Bacillus ToyonensisKoilybayeva et al. 2023
Bacillus AcidiproducensKoilybayeva et al. 2023
Bacillus CereusKoilybayeva et al. 2023
Bacillus SafensisKoilybayeva et al. 2023
Lactobacillus PlantarumMa et al. 2023
Aspergillus FlavusKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaTSBSESI-MSno
ProkaryotaStaphylococcus AureusTSBSESI-MSno
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaEscherichia Colihuman bloodSIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaNeisseria Meningitidishuman bloodSIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas Aeruginosahuman bloodSIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaStaphylococcus Aureushuman bloodSIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStreptococcus Pneumoniaehuman bloodSIFT-MSno
ProkaryotaEscherichia ColiBHISPME/GC-MSno
ProkaryotaEscherichia ColiTSBSPME/GC-MSno
ProkaryotaEscherichia ColiLBSPME/GC-MSno
ProkaryotaStaphylococcus AureusBHISPME/GC-MSno
ProkaryotaStaphylococcus AureusTSBSPME/GC-MSno
ProkaryotaStaphylococcus AureusLBSPME/GC-MSno
ProkaryotaKlebsiella Pneumoniaehuman bloodSPME/GCxGC-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
EukaryotaAspergillus FumigatusSDA + ElastinTD/GC-MSno
ProkaryotaEscherichia ColiMueller–HintonTD/GC-MSno
ProkaryotaHaemophilus InfluenzaeTryptic soya supp. factors X&VTD/GC-MSno
ProkaryotaStaphylococcus Aureustryptic soy brothTD/GC-MSno
ProkaryotaStreptococcus PneumoniaeTryptic soyaTD/GC-MSno
ProkaryotaStaphylococcus EpidermidisTSASPME, GC-MSno
EukaryotaTrichoderma HarzianumPDA plateSPME-GC-MSno
EukaryotaTrichoderma VirensPDA plateSPME-GC-MSno
EukaryotaTrichoderma Harzianumpotato dextrose agarSPME, GC-MSno
EukaryotaTrichoderma Virenspotato dextrose agarSPME, GC-MSno
ProkaryotaPseudomonas Sp.LB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas Sp.LB media, DYGS mediaHS-SPME/GC-MSno
ProkaryotaArthrobacter NicotinovoransLB mediaSPME/GC-MSno
ProkaryotaErwinia PersicinaLB mediaSPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaEscherichia ColiTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus EpidermidisTSB mediaHS-SPME/GC-MSno
EukaryotaMortierella Alpina/globalpinaPD agarPTR-ToF-MSno
EukaryotaMortierella AngustaPD agarPTR-ToF-MSno
EukaryotaMortierella BainieriPD agarPTR-ToF-MSno
EukaryotaLinnemannia ExiguaPD agarPTR-ToF-MSno
EukaryotaLinnemannia GamsiiPD agarPTR-ToF-MSno
EukaryotaMortierella GemmiferaPD agarPTR-ToF-MSno
EukaryotaPodila HorticolaPD agarPTR-ToF-MSno
EukaryotaPodila Humilis/verticilataPD agarPTR-ToF-MSno
EukaryotaLinnemannia HyalinaPD agarPTR-ToF-MSno
EukaryotaEntomortierella ParvisporaPD agarPTR-ToF-MSno
EukaryotaMortierella PseudozygosporaPD agarPTR-ToF-MSno
EukaryotaMortierella SolitariaPD agarPTR-ToF-MSno
EukaryotaMortierella ZonataPD agarPTR-ToF-MSno
ProkaryotaStaphylococcus AureusBHI media, TSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaBacillus VelezensisTSA mediaSPME/GC-MSno
ProkaryotaEscherichia Colirocket lysateHS-SPME/GC-MSno
ProkaryotaBacillus Subtilis1/2 MS mediaSPME/GC-MSno
ProkaryotaBurkholderia TropicaPotato dextrose agarHeadspace trapping/ GC-MSno
ProkaryotaBacillus Sp.n/an/ano
ProkaryotaStaphylococcus Sp.n/an/ano
ProkaryotaClostridium Sp.n/an/ano
ProkaryotaVeillonella Sp.n/an/ano
ProkaryotaBacteroides Fragilisn/an/ano
EukaryotaPenicillium Aurantiogriseumn/an/ano
ProkaryotaBacteroides Biviusn/an/ano
ProkaryotaBacteroides Distasonisn/an/ano
ProkaryotaBacteroides Ovatusn/an/ano
ProkaryotaBacteroides Thetaiotaomicronn/an/ano
ProkaryotaBacteroides Vulgatusn/an/ano
ProkaryotaClostridium Cadaverumn/an/ano
ProkaryotaClostridium Histolyticumn/an/ano
ProkaryotaClostridium Tertiumn/an/ano
ProkaryotaClostridium Bifermentansn/an/ano
ProkaryotaClostridium Fallaxn/an/ano
ProkaryotaClostridium Butyricumn/an/ano
ProkaryotaClostridium Sporogenesn/an/ano
ProkaryotaLactobacillus Casein/an/ano
ProkaryotaLactobacillus Plantarumn/an/ano
ProkaryotaPediococcus Damnosusn/an/ano
ProkaryotaLeuconostoc Cremorisn/an/ano
ProkaryotaLeuconostoc Dextranicumn/an/ano
ProkaryotaLactococcus Lactisn/an/ano
ProkaryotaOenococcus Oenin/an/ano
ProkaryotaPorphyromonas Gingivalisn/an/ano
ProkaryotaPrevotella Loescheiin/an/ano
ProkaryotaPrevotella Intermedian/an/ano
ProkaryotaFusobacterium Nucleatumn/an/ano
ProkaryotaActinobacillus Actinomycetemcomitansn/an/ano
ProkaryotaCapnocytophaga Ochracean/an/ano
ProkaryotaEscherichia Colin/an/ano
ProkaryotaShigella Flexnerin/an/ano
ProkaryotaSalmonella Enterican/an/ano
EukaryotaCandida Tropicalisn/an/ano
ProkaryotaSerratia Sp.n/an/ano
EukaryotaSaccharomyces Cerevisiaen/an/ano
EukaryotaTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)no
EukaryotaTuber Aestivumn/an/ano
EukaryotaTuber Melanosporumn/an/ano
EukaryotaMuscodor Albusn/aHeadspace sampler/GC-MSno
ProkaryotaKlebsiella PneumoniaeVF (peptone, NaCl) and VL broth (casein hydrolysate, yeast extract, beef extract, cysteine, glucose, NaCl)HS-SPME/GC-MS no
ProkaryotaStaphylococcus AureusVF (peptone, NaCl) and VL broth (casein hydrolysate, yeast extract, beef extract, cysteine, glucose, NaCl)HS-SPME/GC-MS no
ProkaryotaAzospirillum BrasilenseTSASPME-GCno
ProkaryotaBacillus PumilusTSASPME-GCno
ProkaryotaAcinetobacter Baumanniipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaActinomyces Europaeuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaActinomyces Naeslundiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaBacteroides Capillosuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaBacteroides Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Difficilepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Perfringenspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Ramosumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Septicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaEnterococcus Faecalispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaEubacterium Lentumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaFusobacterium Simiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaFusobacterium Necrophorumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaLactobacillus Acidophiluspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaNocardia Sp.peptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Anaerobiuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Asaccharolyticuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Prevotiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPropionibacterium Acnespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPropionibacterium Propionicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaProteus Mirabilispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaStaphylococcus Epidermidispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaStreptococcus Agalactiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaStreptococcus Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaStreptococcus Viridanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
EukaryotaCandida Albicanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaStreptococcus UberisGCMS DSQno
ProkaryotaStreptococcus DysgalactiaeGCMS DSQno
ProkaryotaStreptococcus PneumoniaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaHaemophilus InfluenzaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
EukaryotaSaccharomyces Cerevisiaesynthetic minimal mediumGC-MS, EIyes
EukaryotaPenicillium Camembertino
EukaryotaPenicillium Caseifulvumno
ProkaryotaArthrobacter AgilisLB medium/NA mediumSPME-GC/MSno
ProkaryotaPseudomonas BrassicacearumKing's B AgarSPME-GC/MSno
ProkaryotaPseudomonas SimiaeNutrient broth; King's B agarGC/MSno
ProkaryotaLactobacillus Rhamnosuscurd-based broth mediumGC/MSyes
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
ProkaryotaSerratia Sp.LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol)SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation)no
EukaryotaAureobasidium PullulansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaCryptococcus WieringaeYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaHanseniaspora UvarumYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KudriavzeviiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia FermentansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia MembranifaciensYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaSaccharomyces ParadoxusYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaTorulaspora DelbrueckiiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia AnomalaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaMetschnikowia PulcherrimaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
ProkaryotaStaphylococcus EquorumMOLPHS-SPME-GC/MSno
ProkaryotaStaphylococcus EquorumSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaStaphylococcus Equorumtryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.Schaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
EukaryotaWickerhamomyces Anomalusmedium consisted of glucose (20 g/l), peptone (5 g/l), agar (20 g/l) and amoxicillin (1 g/l)SPME with GC-MSno
EukaryotaWickerhamomyces Anomalussolid-state fermentation starter culture DaquSPME coupled with GC-MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno
ProkaryotaAcetobacter Indonesiensissugared green and black teaHS-SPME-GC/MSno
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno
Lactiplantibacillus Plantarumfermentation of ginkgo kernel juiceGC-IMSno
Lactobacillus PlantarumHabanero pepperGC–IMSno
Bacillus Thuringiensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Toyonensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Acidiproducensbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Cereusbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Safensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Lactobacillus Plantarumtuna cooking liquidHS-SPME-GC/MSno
Aspergillus Flavusinoculated potato samplesGC-MSno


Acetonitrile

Mass-Spectra

Compound Details

Synonymous names
ACETONITRILE
Cyanomethane
Methyl cyanide
75-05-8
Ethanenitrile
Ethyl nitrile
Methanecarbonitrile
Methane, cyano-
Acetonitril
Cyanure de methyl
Methylkyanid
MeCN
USAF EK-488
RCRA waste number U003
Methylkyanid [Czech]
NCI-C60822
148642-19-7
NCMe
Cyanure de methyl [French]
Acetonitril [German, Dutch]
HSDB 42
Acetonitrile, anhydrous
CCRIS 1628
CH3CN
Acetonitrile with 0.1% ammonium acetate
NSC 7593
EINECS 200-835-2
UNII-Z072SB282N
DTXSID7020009
CHEBI:38472
AI3-00327
Z072SB282N
NSC-7593
DTXCID909
CH3-C#N
EC 200-835-2
ACETONITRILE WITH 0.1per cent AMMONIUM ACETATE
MFCD00001878
ACETONITRILE (II)
ACETONITRILE [II]
Acetonitrile [UN1648] [Flammable liquid]
ACETONITRILE (MART.)
ACETONITRILE [MART.]
Acetonitril (GERMAN, DUTCH)
Acetonitrile, for DNA synthesis
acetnitrile
Ethanonitrile
CCN
Acetonitrile, for HPLC, gradient grade, >=99.9%
UN1648
RCRA waste no. U003
acetonitile
acetonitnle
acetonitriie
acteonitril
acteonitrile
actonitrile
methylcyanide
methylnitrile
ace-tonitrile
aceto-nitrile
acetonitrile-
Acetonitrile ACS
CC.equiv.N
Acetonitrile LC-MS
Acetonitrile HPLC grade
H3CCN
ACETONITRILE [MI]
Acetonitrile, LCMS grade
ACETONITRILE CLUSTER
bmse000826
bmse000896
ACETONITRILE [HSDB]
Acetonitrile, HPLC Reagent
WLN: NC1
Acetonitrile, >=99.5%
ACETONITRILE [USP-RS]
Acetonitrile, puriss., 95%
CHEMBL45211
METHYL CYANIDE (MECN)
Acetonitrile, for chromatography
Acetonitrile UV/HPLC ACS grade
Acetonitrile, analytical standard
Acetonitrile for preparative HPLC
Acetonitrile, AR, >=99.5%
Acetonitrile, Environmental Grade
DTXSID20183561
NSC7593
Acetonitrile, anhydrous, 99.8%
Acetonitrile, >=99.5% (GC)
Acetonitrile, HPLC gradient Grade
Acetonitrile (anhydrous, 99.8%)
STR02933
Acetonitrile, far UV/gradient grade
Tox21_202481
Acetonitrile, HPLC Grade (Far UV)
Acetonitrile, p.a., dry, 99.9%
Acetonitrile, ReagentPlus(R), 99%
c1151
STL283937
Acetonitrile, Spectrophotometric Grade
Acetonitrile, >=99.8%, for HPLC
Acetonitrile, for HPLC, >=99.9%
AKOS000269067
InChI=1/C2H3N/c1-2-3/h1H
Acetonitrile, HPLC Plus, >=99.9%
MCULE-8803543318
NA 1648
UN 1648
Acetonitrile, >=99.5%, ACS reagent
Acetonitrile, ACS reagent, >=99.5%
Acetonitrile, AldraSORB(TM), 99.8%
Acetonitrile, purum, >=99.0% (GC)
CAS-75-05-8
Acetonitrile (for HPLC) isocratic grade
Acetonitrile, HPLC grade, >=99.93%
NCGC00091552-01
NCGC00260030-01
Acetonitrile 1000 microg/mL in Methanol
Acetonitrile, purification grade, 99.8%
Ultrapure Acetonitrile, for DNA synthesis
Acetonitrile, biotech. grade, >=99.93%
Acetonitrile, p.a., ACS reagent, 99.8%
Acetonitrile, SAJ first grade, >=99.0%
A0060
A0293
A0793
Acetonitrile, JIS special grade, >=99.5%
NS00002918
Acetonitrile, anhydrous, ZerO2(TM), 99.8%
EN300-21632
Acetonitrile, for HPLC-GC, >=99.8% (GC)
Acetonitrile, for UHPLC, for mass spectrometry
Acetonitrile, Supergradient HPLC Grade (Far UV)
Acetonitrile, spectrophotometric grade, >=99.5%
Q408047
Acetonitrile, for HPLC, for UV, >=99.9% (GC)
Acetonitrile, puriss. p.a., ACS reagent, 99.8%
J-008497
Acetonitrile, for preparative HPLC, >=99.8% (GC)
Acetonitrile, for synthesis of DNA, >=99.9% (GC)
for DNA synthesis, inverted exclamation markY99.9%(GC)
Acetonitrile with 0.1% Trifluoroacetic acid, LC-MS Grade
Acetonitrile, electronic grade, 99.999% trace metals basis
Acetonitrile, for HPLC, gradient grade, >=99.9% (GC)
Acetonitrile, for HPLC, gradient grade, >=99.90% (GC)
Acetonitrile, puriss. p.a., ACS reagent, >=99.5% (GC)
Acetonitrile with 0.1% ammonium acetate, tested for UHPLC-MS
Acetonitrile, for protein sequence analysis, >=99.8% (GC)
Acetonitrile, Vetec(TM) reagent grade, anhydrous, >=99.8%
Acetonitrile, Preparateur, >=99.9% (GC), Customized plastic drum
Acetonitrile, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99.5% (GC)
Acetonitrile, Pharmaceutical Secondary Standard; Certified Reference Material
Acetonitrile, Preparateur, >=99.9% (GC), One-time steel-plastic (SP) drum
Alcohol Determination - Acetonitrile, United States Pharmacopeia (USP) Reference Standard
Acetonitrile for oligo synthesis (Water < 10 ppm) NC-0609 2.5L 4 GL45 thread 4 L US38 thread, emp Biotech GmbH
Acetonitrile for oligo synthesis (Water content < 20 ppm) 2.5L GL45 thread, 4L US38 thread emp Biotech GmbH
Residual Solvent - Acetonitrile, Pharmaceutical Secondary Standard; Certified Reference Material
Residual Solvent Class 2 - Acetonitrile, United States Pharmacopeia (USP) Reference Standard
Microorganism:

Yes

IUPAC nameacetonitrile
SMILESCC#N
InchiInChI=1S/C2H3N/c1-2-3/h1H3
FormulaC2H3N
PubChem ID6342
Molweight41.05
LogP0
Atoms3
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationnitriles nitrogen compounds
CHEBI-ID38472
Supernatural-IDSN0408370

mVOC Specific Details

Boiling Point
DegreeReference
81.6 °C peer reviewed
Volatilization
The Henry's Law constant for acetonitrile is 3.45X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that acetonitrile is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 12 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 7.5 days(SRC). Acetonitrile's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Acetonitrile is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 88.8 mm Hg(3).
Literature: (1) Gaffney JS et al; Environ Sci Technol 21: 519-23 (1987) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Boublik T et al; The Vapour Pressures of Pure Substances. Vol 17. Amsterdam, Netherlands: Elsevier Sci Publ (1984)
Soil Adsorption
Acetonitrile has a reported measured Koc Value of 2.2(1). According to a classification scheme(2), this Koc value suggests that acetonitrile is expected to have very high mobility in soil(SRC).
Literature: (1) Chu W, Chan KH; Sci Total Environ 248: 1-10 (2000) (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
88.8 mm Hg at 25 deg CBoublik, T., Fried, V., and Hala, E., The Vapour Pressures of Pure Substances. Second Revised Edition. Amsterdam: Elsevier, 1984.
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANAZhu et al. 2010
ProkaryotaPseudomonas AeruginosaNANAZhu et al. 2010
ProkaryotaStaphylococcus AureusNANAZhu et al. 2010
ProkaryotaPseudomonas AeruginosaNANACarroll et al. 2005
ProkaryotaKlebsiella PneumoniaeNARees et al. 2017
ProkaryotaKlebsiella Pneumoniaeclinical isolate,bacteremic patientsRees et al. 2017
EukaryotaTrichoderma Viriden/aNAWheatley et al. 1997
EukaryotaTrichoderma Pseudokoningiin/aNAWheatley et al. 1997
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiTSBSESI-MSno
ProkaryotaPseudomonas AeruginosaTSBSESI-MSno
ProkaryotaStaphylococcus AureusTSBSESI-MSno
ProkaryotaPseudomonas AeruginosaBlood agarSIFT-MSno
ProkaryotaPseudomonas AeruginosaPseudomonas selectiveSIFT-MSno
ProkaryotaKlebsiella PneumoniaeLBSPME / GCxGC-TOFMSno
ProkaryotaKlebsiella PneumoniaeBHI, LB, MHB, TSBSPME / GCxGC-TOFMSno
EukaryotaTrichoderma VirideMalt extract/Low mediumGC/MSno
EukaryotaTrichoderma PseudokoningiiMalt extract/Low mediumGC/MSno


Formonitrile

Compound Details

Synonymous names
hydrogen cyanide
hydrocyanic acid
Formonitrile
Prussic acid
Cyanwasserstoff
Blausaeure
Formic anammonide
Zaclondiscoids
Evercyn
Cyclon
74-90-8
Cyclone B
Aero Liquid HCN
Agent AC
Cyaanwaterstof
Blauwzuur
Cyjanowodor
Acido cianidrico
Acide cyanhydrique
methanenitrile
Caswell No. 483
Hydrogen cyanide [ISO]
hydridonitridocarbon
RCRA waste number P063
Blausaeure [German]
Carbon hydride nitride (CHN)
HSDB 165
HCN
UN 1051
hydrogen(nitridocarbonate)
EINECS 200-821-6
[CHN]
UNII-2WTB3V159F
AC [Cyanide]
EPA Pesticide Chemical Code 045801
AI3-31100-X
BRN 1718793
2WTB3V159F
143334-20-7
CHEBI:18407
Acide cyanhydrique [ISO-French]
Carbon nitride (C3N4)
HYDROCYANICUM ACIDUM
Zyklon B
CHEMBL183419
DTXSID9024148
EC 200-821-6
AC (CHEMICAL WARFARE AGENT)
AC (Cyanide)
Blausaeure (German)
(CHN)
Blauwzuur [Dutch]
Cyjanowodor [Polish]
Acide cyanhydrique (ISO-French)
Cyaanwaterstof [Dutch]
Cyanwasserstoff [German]
Acido cianidrico [Italian]
Acid, Hydrocyanic
Cyanide, Hydrogen
Acide cyanhydrique [French]
Graphitic Carbon Nitride
NA1613
UN1051
UN1613
UN1614
UN3294
RCRA waste no. P063
Zootic acid
Nitrilomethane #
Prussic acid, anhydrous, stabilized
Carbon hydride nitride
Hydrocyanic acid, anhydrous, stabilized
Hydrogen cyanide, anhydrous, stabilized
Prussic acid, unstabilized
UN 1613 (Salt/Mix)
UN 1614 (Salt/Mix)
HYDROGEN CYANIDE [MI]
Hydrocyanic acid (prussic), unstabilized [Forbidden]
DTXCID004148
HYDROGEN CYANIDE [HSDB]
HYDROGEN CYANIDE [WHO-DD]
HYDROCYANICUM ACIDUM [HPUS]
BDBM50152968
Hydrocyanic acid, anhydrous, stabilized, absorbed in a porous inert material
Hydrogen cyanide, anhydrous, stabilized, absorbed in a porous inert material
Prussic acid, anhydrous, stabilized, absorbed in a porous inert material
NA 1051
Hydrocyanic acid (prussic), unstabilized
CHN
Hydrogen cyanide, stabilized with <3% water
NS00077168
C01326
Q3416481
Graphitic carbon nitride, 99%, length: 1 - 10 mum
hydridonitridocarbonhydrogen(nitridocarbonate)methanenitrile
Hydrogen cyanide, stabilized with <3% water [UN1051] [Poison]
Hydrogen cyanide, stabilized, with <3% water and absorbed in a porous inert material
Hydrogen cyanide, stabilized, with <3% water and absorbed in a porous inert material [UN1614] [Poison]
Microorganism:

Yes

IUPAC nameformonitrile
SMILESC#N
InchiInChI=1S/CHN/c1-2/h1H
FormulaCHN
PubChem ID768
Molweight27.025
LogP0.1
Atoms2
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationnitriles nitrogen compounds
CHEBI-ID18407
Supernatural-IDSN0203229

mVOC Specific Details

Boiling Point
DegreeReference
25.63 °C peer reviewed
Volatilization
Volatilization is expected to be the dominant fate process for hydrogen cyanide(1). A pKa of 9.2(2) indicates hydrogen cyanide will exist partially in the anion form at pH values of 5 to 9(SRC). At pH <9.2, most of the free cyanide should exist as hydrogen cyanide, a volatile form of cyanide. Wide variations in the rate of volatilization are expected since this process is affected by a number of parameters including temperature, pH, wind speed, and cyanide concentration(1). The Henry's Law constant for the neutral species is 1.33X10-4 atm-cu m/mole(3). This Henry's Law constant indicates that hydrogen cyanide is expected to volatilize from water surfaces(4). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(4) is estimated as 5 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(4) is estimated as 3 days(SRC). Hydrogen cyanide's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Hydrogen cyanide is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 742 mm Hg(5).
Soil Adsorption
The Koc of hydrogen cyanide is estimated as 15(SRC), using a log Kow of -0.25(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that hydrogen cyanide is expected to have very high mobility in soil. The pKa of hydrogen cyanide is 9.2(4), indicating that this compound will exist partially in the anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5).

Species emitting the compound
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBlood agarSIFT-MSno
ProkaryotaPseudomonas AeruginosaPseudomonas selectiveSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno


N,N-dimethylmethanamine

Mass-Spectra

Compound Details

Synonymous names
trimethylamine
N,N-dimethylmethanamine
75-50-3
Methanamine, N,N-dimethyl-
N-Trimethylamine
Dimethylmethaneamine
Trimethylamin
(CH3)3N
FEMA No. 3241
FEMA Number 3241
N,N,N-trimethylamine
NMe3
Trimethylamine anhydrous
CCRIS 6283
HSDB 808
trimethyl-amine
AI3-15639
EINECS 200-875-0
UNII-LHH7G8O305
UN1083
UN1297
TRIMETHYLAMINUM
LHH7G8O305
tridimethylaminomethane
DTXSID2026238
CHEBI:18139
Trimethylamine, anhydrous
Methylamine, N,N-dimethyl-
DTXCID106238
N(CH3)3
EC 200-875-0
MFCD00008327
Trimethylamine, anhydrous [UN1083] [Flammable gas]
TRIMETHYL AMINE
(CH3)3NH
(CH3)3NH+
MELDONIUM DIHYDRATE IMPURITY A (EP IMPURITY)
MELDONIUM DIHYDRATE IMPURITY A [EP IMPURITY]
ACETYLCHOLINE CHLORIDE IMPURITY C (EP IMPURITY)
ACETYLCHOLINE CHLORIDE IMPURITY C [EP IMPURITY]
tri-methylamine
KEN
dimethylamino methane
trimethylamine (tma)
N,N-dimethyl-Methanamine
N,N-Dimethylmethanamine #
bmse000224
TRIMETHYLAMINE [MI]
NCIOpen2_007868
TRIMETHYLAMINE [FCC]
TRIMETHYLAMINE [FHFI]
TRIMETHYLAMINE [HSDB]
Trimethylamine, >=99.0%
Trimethylamine, >=99.5%
Trimethylamine 2.0M in THF
TRIMETHYLAMINUM [HPUS]
CHEMBL439723
GTPL5521
Trimethylamine 2M in Isopropanol
TRIMETHYLAMINE, (ANHYDROUS)
Trimethylamine, 43-49% in water
Trimethylamine, anhydrous, >=99%
Tox21_302355
BDBM50416499
NSC101179
STL264242
AKOS000119986
MCULE-7903544426
NSC-101179
UN 1083
UN 1297
CAS-75-50-3
NCGC00255170-01
InChI=1/C3H9N/c1-4(2)3/h1-3H
NS00006832
T0464
T2268
T2704
T2892
T2893
T3567
T3614
T3847
C00565
Trimethylamine (ca.8% in N,N-Dimethylformamide)
Q423953
Trimethylamine (~25 wt. % solution in methanol)
Trimethylamine (~30 wt. % Solution in Ethanol)
Trimethylamine (ca. 8% in Toluene, ca. 1mol/L)
F1908-0091
Trimethylamine (ca. 13% in Acetonitrile, ca. 2mol/L)
Trimethylamine (ca. 25% in Isopropyl Alcohol, ca. 3mol/L)
Trimethylamine solution (ca. 28% in Water, ca. 4.3mol/L)
Trimethylamine solution (ca. 25% in Isopropyl Alcohol, ca. 3mol/L)
Trimethylamine, anhydrous, cylinder, with 316SS needle valve, 99%
Microorganism:

Yes

IUPAC nameN,N-dimethylmethanamine
SMILESCN(C)C
InchiInChI=1S/C3H9N/c1-4(2)3/h1-3H3
FormulaC3H9N
PubChem ID1146
Molweight59.11
LogP0.3
Atoms4
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationamines nitrogen compounds
CHEBI-ID18139
Supernatural-IDSN0103747

mVOC Specific Details

Boiling Point
DegreeReference
2.87 °C peer reviewed
Volatilization
The Henry's Law constant for trimethylamine is 1.0X10-4 atm-cu m/mole(1). This Henry's Law constant indicates that trimethylamine is expected to volatilize from water surfaces(2). However, trimethylamine is a base with pKa of 9.8(3) and will exist primarily as a cation under environmental conditions (pH 5-9)(SRC). Thus, volatilization of trimethylamine from moist soil and water surfaces will not be an important fate process because cations do not volatilize(SRC). The potential for volatilization of trimethylamine from dry soil surfaces may exist(SRC) based upon a vapor pressure of 1,610 mm Hg(4).
Literature: (1) Christie AO, Crisp DJ; J Appl Chem 17: 11-4 (1967) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Perinn DD; Dissociation Constants of Organic Bases in Aqueous Solution. IUPAC Chem Data Ser: Suppl 1972. London, England: Buttersworth (1972) (4) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng, NY, NY: Hemisphere Pub Corp, 5 Vol (1989)
Soil Adsorption
The Koc of trimethylamine is estimated as 29(SRC), using a log Kow of 0.16(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that trimethylamine is expected to have very high mobility in soil(SRC). However, trimethylamine has a pKa of 9.8(4) and should exist primarily as a cation under environmental conditions (pH 5-9)(SRC). As a result, trimethylamine may have greater adsorption and less mobility than its estimated Koc value indicates since cations generally adsorb more strongly to soils containing organic carbon and clay than neutral species(5). Sorption coefficients for trimethylamine adsorption on montmorillonite, kaolinite and Flax Pond sediment (7% clay, 2.8% OM; Long Island, NY) were 15, 2 and 7 ml/g, respectively(6). The trimethylamine cation adsorbed strongest to the negatively-charged montmorillonite via electrostatic interactions(6).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 9 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17- 28 (1983) (4) Perrin DD; Dissociation Constants of Organic Bases in Aqueous Solution. IUPAC Chem Data Ser: Suppl 1972. Buttersworth, London (1972) (5) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000) (6) Wang XC, Lee C; Mar Chem 44: 1-23 (1993)
Vapor Pressure
PressureReference
1610 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEnterococcus FaecalisTYESIFT-MSno
ProkaryotaEscherichia ColiBacT/ALERT FASIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaTYESIFT-MSno
ProkaryotaStaphylococcus AureusBacT/ALERT FASIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStreptococcus PneumoniaeBacT/ALERT FASIFT-MSno
EukaryotaTilletia Cariesn/an/ano
EukaryotaTilletia Foetidan/an/ano
EukaryotaTilletia Controversan/an/ano
ProkaryotaStreptomyces Sp.YPD agarGCxGC-TOFMSyes
ProkaryotaStaphylococcus Aureusno


Pyridine-3-carboxylic Acid

Compound Details

Synonymous names
nicotinic acid
niacin
59-67-6
Pyridine-3-carboxylic acid
3-pyridinecarboxylic acid
vitamin B3
3-Carboxypyridine
wampocap
Niaspan
Acidum nicotinicum
nicolar
Apelagrin
Pellagrin
Akotin
Daskil
Efacin
Pelonin
Linic
nicamin
nicobid
nicocap
Enduracin
Nicodelmine
Niconacid
Nicotinipca
Pellagramin
Direktan
Nicacid
Nicangin
Peviton
Bionic
Diacin
Nicyl
Nyclin
Niac
Vitaplex N
Davitamon PP
Nico-Span
Tega-Span
Nicocidin
Nicocrisina
Niconazid
Nicoside
Nicotamin
Nicotene
Nicovasan
Nicovasen
Nipellen
SK-Niacin
Naotin
Niacor
Nicodon
Niconat
Nicosan 3
Nicosyl
Nicotil
Tinic
3-Carboxylpyridine
Nicotine acid
nicotinate
Slo-niacin
NICO
3-Picolinic acid
Nicotinsaure
Nico-400
Acide nicotinique
Pyridine-beta-carboxylic acid
Nicagin
anti-Pellagra vitamin
Caswell No. 598
PP Factor
Kyselina nikotinova
P.P. factor
Pellagra preventive factor
S115
Nicotinsaure [German]
Acido nicotinico
3-Pyridylcarboxylic acid
m-Pyridinecarboxylic acid
Kyselina nikotinova [Czech]
MFCD00006391
niacine
CCRIS 1902
Pyridine-carboxylique-3
EPA Pesticide Chemical Code 056701
Acide nicotinique [INN-French]
Acido nicotinico [INN-Spanish]
Acidum nicotinicum [INN-Latin]
HSDB 3134
Pyridine-carboxylique-3 [French]
AI3-18994
Pyridinecarboxylic acid, 3-
Niacin [USP]
SR 4390
BRN 0109591
Niacin extended release
Nicotinic acid [INN]
NAH
CHEMBL573
beta-pyridinecarboxylic acid
NSC-169454
MLS000069603
Pyridine-.beta.-carboxylic acid
DTXSID1020932
CHEBI:15940
Niacin (USP)
2679MF687A
P.P. factor-pellagra preventive factor
CAS-59-67-6
NCGC00016268-02
SMR000059024
[5, 6-3H]-niacin
DTXCID10932
Niacin [USAN]
Nicotinicacid
NIO
Niacin (nicotinic acid)
SR-01000722017
EINECS 200-441-0
NIASPAN TITRATION STARTER PACK
NSC 169454
pellagra
Nikotinsaeure
Ncotnc acd
UNII-2679MF687A
preventative factor
antipellagra vitamin
Niaspan (TN)
3-Pyridylcarboxylate
3PyrCOOH
[3H]nicotinic acid
Niacor (TN)
Nicotinic Acid,(S)
[3H]-Nicotinic acid
Spectrum_001063
Nicotinic acid, Ph Eur
NIACIN [VANDF]
NIACIN [HSDB]
NIACIN [INCI]
Nicotinic acid (Niacin)
5-pyridinecarboxylic acid
NIACIN [FCC]
NIACIN [USP-RS]
Opera_ID_1346
Prestwick0_000881
Prestwick1_000881
Prestwick2_000881
Prestwick3_000881
Pyridine-3-carbonic acid
Spectrum2_000006
Spectrum3_000515
Spectrum4_000965
Spectrum5_001287
VITAMIN B-3
3-Pyridyl carboxylic acid
Nicotinic acid-d3(major)
WLN: T6NJ CVQ
3-pyridine carboxylic acid
bmse000104
Nicotinic acid, >=98%
Nicotinic acid, USP grade
EC 200-441-0
SCHEMBL1433
NICOTINIC ACID [MI]
Oprea1_514398
VITAMIN B3 [VANDF]
BSPBio_000662
BSPBio_002069
KBioGR_001309
KBioSS_001543
NIACIN [ORANGE BOOK]
NICOTINIC ACID [JAN]
5-22-02-00057 (Beilstein Handbook Reference)
Nicotinic acid (Vitamin B3)
BIDD:GT0644
DivK1c_000695
Nicotinic acid (JP17/INN)
SIMCOR COMPONENT NIACIN
SPECTRUM1500430
.beta.-Pyridinecarboxylic acid
SPBio_000011
SPBio_002881
ADVICOR COMPONENT NIACIN
NIACIN [USP MONOGRAPH]
NICOTINIC ACID [VANDF]
BPBio1_000730
GTPL1588
GTPL1594
NICOTINIC ACID [MART.]
NICOTINIC ACID [WHO-DD]
NICOTINIC ACID [WHO-IP]
BDBM23515
HMS502C17
KBio1_000695
KBio2_001543
KBio2_004111
KBio2_006679
KBio3_001569
ABT-919
NIACIN COMPONENT OF SIMCOR
NICOTINIC ACID [EMA EPAR]
NINDS_000695
HMS1570B04
HMS1920P17
HMS2091H22
HMS2097B04
HMS2236A05
HMS3259K21
HMS3371E07
HMS3655K08
HMS3714B04
NIACIN COMPONENT OF ADVICOR
Pharmakon1600-01500430
Nicotinic acid, analytical standard
BCP16301
HY-B0143
STR00112
Tox21_110337
Tox21_201420
Tox21_302904
AC8691
BBL037343
CCG-38340
NICOTINIC ACID [EP IMPURITY]
Nicotinic acid, for synthesis, 99%
NSC169454
NSC757241
s1744
STK301803
NICOTINIC ACID [EP MONOGRAPH]
AKOS000118980
Nicotinic acid, >=99.5% (HPLC)
Tox21_110337_1
AM81316
CS-1946
DB00627
MCULE-3788394698
NC00524
Nicotinic Acid 1.0 mg/ml in Methanol
NSC-757241
PS-4255
SDCCGMLS-0066610.P001
IDI1_000695
NCGC00016268-01
NCGC00016268-03
NCGC00016268-04
NCGC00016268-05
NCGC00016268-08
NCGC00016268-09
NCGC00016268-13
NCGC00094734-01
NCGC00094734-02
NCGC00256537-01
NCGC00258971-01
AC-22484
ACIDUM NICOTINICUM [WHO-IP LATIN]
BP-21419
NCI60_001041
Nicotinic acid, NIST(R) SRM(R) 148
Nicotinic acid, plant cell culture tested
SY011111
SBI-0051456.P003
DB-007765
Nicotinic Acid [Matrix for MALDI-TOF/MS]
AB00052050
N0082
N1103
Nicotinic acid 10 microg/mL in Acetonitrile
Nicotinic acid, purum, >=99.0% (HPLC)
NS00003500
SW197229-3
EN300-16693
C00253
D00049
Nicotinic acid, SAJ special grade, >=99.5%
AB00052050-13
AB00052050_14
AB00052050_15
Nicotinic acid, meets USP testing specifications
AC-907/25014105
L001199
METHYL NICOTINATE IMPURITY A [EP IMPURITY]
Nicotinic acid, Vetec(TM) reagent grade, >=98%
Q134658
J-523605
SR-01000722017-2
SR-01000722017-3
SR-01000722017-4
Z56755709
3DDB011E-F3A6-45B6-A2D2-77B2A6E8936E
F2191-0082
Niacin, United States Pharmacopeia (USP) Reference Standard
Nicotinic acid, certified reference material, TraceCERT(R)
Nicotinic acid, European Pharmacopoeia (EP) Reference Standard
Nicotinic acid, matrix substance for MALDI-MS, >=99.5% (HPLC)
InChI=1/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9
Nicotinic acid, for inorganic trace analysis, >=99.999% (metals basis)
Niacin (Nicotinic Acid), Pharmaceutical Secondary Standard; Certified Reference Material
101113-41-1
Nicotinic acid, BioReagent, suitable for cell culture, suitable for insect cell culture, suitable for plant cell culture, >=98%
Microorganism:

Yes

IUPAC namepyridine-3-carboxylic acid
SMILESC1=CC(=CN=C1)C(=O)O
InchiInChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
FormulaC6H5NO2
PubChem ID938
Molweight123.11
LogP0.4
Atoms9
Bonds1
H-bond Acceptor3
H-bond Donor1
Chemical Classificationpyridines aromatic compounds organic acids carboxylic acids acids heterocyclic compounds nitrogen compounds
CHEBI-ID15940
Supernatural-IDSN0296292

mVOC Specific Details

Boiling Point
DegreeReference
NA NA peer reviewed
Volatilization
A pKa of 4.75(1) indicates nicotinic acid will exist almost entirely in the anion form at pH values of 5 to 9 and, therefore, volatilization from water surfaces is not expected to be an important fate process(SRC). Nicotinic acid is not expected to volatilize from dry soil surfaces(SRC) based upon a an estimated vapor pressure of 9.4X10-5 mm Hg(SRC), determined from a fragment constant method(2).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of nicotinic acid can be estimated to be 8(SRC). According to a classification scheme(2), this estimated Koc value suggests that nicotinic acid is expected to have very high mobility in soil. The pKa of nicotinic acid is 4.75(3), indicating that this compound will exist almost entirely in the anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(4).
Massbank-Links
Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP005708
Massbank Spectrum MSBNK-Fiocruz-FIO00515
Massbank Spectrum MSBNK-Fiocruz-FIO00516
Massbank Spectrum MSBNK-Fiocruz-FIO00517
Massbank Spectrum MSBNK-Fiocruz-FIO00518
Massbank Spectrum MSBNK-Fiocruz-FIO00519
Massbank Spectrum MSBNK-Kazusa-KZ000065
Massbank Spectrum MSBNK-Kazusa-KZ000167
Massbank Spectrum MSBNK-Keio_Univ-KO001502
Massbank Spectrum MSBNK-Keio_Univ-KO001503
Massbank Spectrum MSBNK-Keio_Univ-KO001504
Massbank Spectrum MSBNK-Keio_Univ-KO001505
Massbank Spectrum MSBNK-Keio_Univ-KO001506
Massbank Spectrum MSBNK-Keio_Univ-KO003587
Massbank Spectrum MSBNK-Keio_Univ-KO003588
Massbank Spectrum MSBNK-Keio_Univ-KO003589
Massbank Spectrum MSBNK-Keio_Univ-KO003590
Massbank Spectrum MSBNK-Keio_Univ-KO003591
Massbank Spectrum MSBNK-LCSB-LU048801
Massbank Spectrum MSBNK-LCSB-LU048802
Massbank Spectrum MSBNK-LCSB-LU048803
Massbank Spectrum MSBNK-LCSB-LU048804
Massbank Spectrum MSBNK-LCSB-LU048805
Massbank Spectrum MSBNK-LCSB-LU048806
Massbank Spectrum MSBNK-Osaka_Univ-OUF00390
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS007601
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS007602
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS007603
Massbank Spectrum MSBNK-RIKEN_ReSpect-PT100760
Massbank Spectrum MSBNK-RIKEN_ReSpect-PT200760
Massbank Spectrum MSBNK-RIKEN-PR010189
Massbank Spectrum MSBNK-RIKEN-PR100045
Massbank Spectrum MSBNK-RIKEN-PR100046
Massbank Spectrum MSBNK-RIKEN-PR100505

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANAKaeslin et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaBHISESI-MSno


Butane-2,3-dione

Mass-Spectra

Compound Details

Synonymous names
2,3-butanedione
diacetyl
biacetyl
Butane-2,3-dione
431-03-8
dimethylglyoxal
Butanedione
dimethyl diketone
2,3-diketobutane
Dimethyl glyoxal
2,3-Butadione
2,3-dioxobutane
butadione
Glyoxal, dimethyl-
2,3-butandione
Diacetyl (natural)
FEMA No. 2370
Butan-2,3-dione
CCRIS 827
HSDB 297
NSC 8750
MFCD00008756
UN2346
2,3-Butanedione-13C2
AI3-03313
K324J5K4HM
DTXSID6021583
CHEBI:16583
NSC-8750
2.3-butanedione
EINECS 207-069-8
BRN 0605398
UNII-K324J5K4HM
butane 2
butane-2
Biacetyl; BDM
2,3 butandione
Buta-2,3-dione
DIACETYL [FHFI]
DIACETYL [HSDB]
DIACETYL [FCC]
Butanedione [UN2346] [Flammable liquid]
DIACETYL [MI]
Lopac-D-3634
Butanedione [UN2346]
2,3-Butanedione, 97%
Lopac0_000387
4-01-00-03644 (Beilstein Handbook Reference)
Diacetyl, natural, >=95%
WLN: 1VV1
(CH3CO)2
CHEMBL365809
DTXCID701583
SGCUT00113
2,3-Butanedione (8CI,9CI)
BDBM22725
NSC8750
HMS3261M15
to_000005
Tox21_201218
Tox21_500387
LMFA12000012
2,3-Butanedione, analytical standard
AKOS000118816
Diacetyl 1000 microg/mL in Methanol
CCG-204481
LP00387
MCULE-5742661187
SDCCGSBI-0050374.P002
NCGC00015336-01
NCGC00015336-02
NCGC00015336-03
NCGC00015336-04
NCGC00015336-05
NCGC00015336-06
NCGC00015336-07
NCGC00090746-01
NCGC00090746-02
NCGC00090746-03
NCGC00258770-01
NCGC00261072-01
CAS-431-03-8
DB-003226
B0682
Butanedione [UN2346] [Flammable liquid]
EU-0100387
NS00003558
EN300-19494
C00741
D 3634
W18292
A826155
Q408916
SR-01000075811
InChI=1/C4H6O2/c1-3(5)4(2)6/h1-2H
SR-01000075811-1
DEE64962-0BD5-454C-8BDA-FDBD33C47181
F0001-1188
BUO
Microorganism:

Yes

IUPAC namebutane-2,3-dione
SMILESCC(=O)C(=O)C
InchiInChI=1S/C4H6O2/c1-3(5)4(2)6/h1-2H3
FormulaC4H6O2
PubChem ID650
Molweight86.09
LogP-1.3
Atoms6
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationalcohols ketones
CHEBI-ID16583
Supernatural-IDSN0313939

mVOC Specific Details

Boiling Point
DegreeReference
87.5 °C peer reviewed
Volatilization
The Henry's Law constant for diacetyl is 1.33X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that diacetyl is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 2.7 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 22 days(SRC). Diacetyl's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Diacetyl is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 56.8 mm Hg(3).
Literature: (1) Betterton EA; Atmos Environ 25A:1473-7 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Boublik T et al; The vapor pressures of pure substances. Vol. 17. Amsterdam, Netherlands: Elsevier Sci. Publ (1984)
Soil Adsorption
The Koc of diacetyl is estimated as 1(SRC), using a log Kow of -1.34(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that diacetyl is expected to have very mobility in soil.
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 9 (1995) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of May 31, 2016: http://www2.epa.gov/tsca-screening-tools (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
56.8 mm Hg at 25 deg CBoublik, T., Fried, V., and Hala, E., The Vapour Pressures of Pure Substances. Second Revised Edition. Amsterdam: Elsevier, 1984.
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaKlebsiella PneumoniaeNANARees et al. 2016a
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
ProkaryotaStreptococcus PneumoniaeNANAMellors et al. 2018
ProkaryotaHaemophilus InfluenzaeNANAFilipiak et al. 2012
ProkaryotaStaphylococcus AureusNANAFilipiak et al. 2012
ProkaryotaStreptococcus PneumoniaeNANAFilipiak et al. 2012
ProkaryotaErwinia AmylovoraNACellini et al. 2018
ProkaryotaKlebsiella PneumoniaeNARees et al. 2017
EukaryotaFusarium OxysporumonionWang et al. 2018
EukaryotaFusarium ProliferatumonionWang et al. 2018
ProkaryotaBacillus AmyloliquefaciensLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus VelezensisNAMülner et al. 2020
ProkaryotaBacillus LicheniformisLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
EukaryotaFusarium OxysporumNAMoisan et al. 2021
ProkaryotaBacillus Velezensisinhibite the growth of Botrytis cinerea VG1, Monilinia fructicola VG 104, Monilinia laxa VG 105, Penicillium digitatum VG 20, Penicillium expansum CECT 20140, Penicillium italicum VG 102NACalvo et al. 2020
ProkaryotaBacillus Velezensisinhibite the growth of Botrytis cinerea VG1, Monilinia fructicola VG 104, Monilinia laxa VG 105, Penicillium digitatum VG 20, Penicillium expansum CECT 20140, Penicillium italicum VG 111NACalvo et al. 2020
ProkaryotaStreptococcus PyogenesNational Collection of Type CulturesSlade et al. 2022
ProkaryotaStaphylococcus AureusNational Collections of Industrial Food and Marine Bacteria, American Type Culture Collection, Southmead HospitalSlade et al. 2022
EukaryotaTuber Magnatumcollected from natural truffle orchards in Istria (Croatia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Baranya (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Somogy (Hungary) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Abruzzo (Italy) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Kalubara (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
EukaryotaTuber Magnatumcollected from natural truffle orchards in Srem (Serbia) during one truffle season (October 2018–January 2019)Niimi et al. 2021
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaStaphylococcus EpidermidisAmerican Type Culture CollectionJenkins and Bean 2020
EukaryotaMalassezia RestrictaFungal Biodiversity Center (WesterdijkInstitute, Utrecht, The Netherlands)Rios-Navarro et al. 2023
EukaryotaMalassezia SympodialisFungal Biodiversity Center (WesterdijkInstitute, Utrecht, The Netherlands)Rios-Navarro et al. 2023
ProkaryotaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
ProkaryotaStreptococcus Uberisn/aNAHettinga et al. 2008
ProkaryotaStreptococcus Dysgalactiaen/aNAHettinga et al. 2008
ProkaryotaCoagulase-negative Staphylococcin/aNAHettinga et al. 2008
ProkaryotaEscherichia ColiNational collection of type cultures (NCTC) UKTait et al. 2014
ProkaryotaStaphylococcus AureusNational collection of type cultures (NCTC) UKTait et al. 2014
EukaryotaTuber Aestivumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
EukaryotaTuber Melanosporumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
ProkaryotaBacillus Amyloliquefaciensn/aNALee et al. 2012
ProkaryotaBacillus Subtilisn/aNALee et al. 2012
ProkaryotaPaenibacillus Polymyxan/aNALee et al. 2012
ProkaryotaStaphylococcus Aureusn/aNAHettinga et al. 2008
ProkaryotaEscherichia Colin/aNAHettinga et al. 2008
ProkaryotaStaphylococcus Sciurinafrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al. 2011
ProkaryotaBacillus AmyloliquefaciensnanaAsari et al. 2016
ProkaryotaLactobacillus Rhamnosuscan be used to modify or intensify the flavour of industrial cheeses or fermented milks or to preserve the peculiar flavour of traditional dairy productsNAPogačić et al. 2016
ProkaryotaLactobacillus RhamnosusnanaPogačić et al. 2016
EukaryotaTuber BorchiiAroma active compound in Tuber melanosporum and Tuber aestivum syn Tuber uncinatumnaSplivallo and Ebeler 2015
ProkaryotaStaphylococcus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaPaenibacillus Polymyxacollection TU GrazRybakova et al. 2017
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
Bacillus ThuringiensisKoilybayeva et al. 2023
Bacillus ToyonensisKoilybayeva et al. 2023
Bacillus SafensisKoilybayeva et al. 2023
Saccharomyces CerevisiaePeng et al. 2023
Staphylococcus AureusWang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaKlebsiella Pneumoniaehuman bloodSPME/GCxGC-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno
ProkaryotaStreptococcus PneumoniaeModified Lacks MediaSPME/GCxGC-MSno
ProkaryotaHaemophilus InfluenzaeTryptic soya supp. factors X&VTD/GC-MSno
ProkaryotaStaphylococcus Aureustryptic soy brothTD/GC-MSno
ProkaryotaStreptococcus PneumoniaeTryptic soyaTD/GC-MSno
ProkaryotaErwinia AmylovoraLuria-Bertani (LB)PTR-MS / SPME / GC-MSno
ProkaryotaKlebsiella PneumoniaeLBSPME / GCxGC-TOFMSno
EukaryotaFusarium OxysporumLiquid onion extract medium (LOM)SPME, GC-MSyes
EukaryotaFusarium ProliferatumLiquid onion extract medium (LOM)SPME, GC-MSyes
ProkaryotaBacillus Amyloliquefaciensnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Velezensisnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Licheniformisnutrient agarHS-SPME/GC-MSno
EukaryotaFusarium Oxysporum1/5th PDA mediumGC-MSno
ProkaryotaBacillus VelezensisMOLP mediaSPME/GC-MSyes
ProkaryotaStreptococcus PyogenesTS agar/blood agarHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusTS agar/blood agarHS-SPME/GC-MSno
EukaryotaTuber MagnatumGC-MS-Ono
ProkaryotaStaphylococcus AureusBHI media, TSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaStaphylococcus EpidermidisLB mediaHS-SPME/GC×GC-TOFMSno
EukaryotaMalassezia Restrictamodified Dixon agarHS-SPME/GC-MSno
EukaryotaMalassezia Sympodialismodified Dixon agarHS-SPME/GC-MSno
ProkaryotaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
ProkaryotaStreptococcus UberisMilkHS-SPME/GC-MS no
ProkaryotaStreptococcus DysgalactiaeMilkHS-SPME/GC-MS no
ProkaryotaCoagulase-negative StaphylococciMilkHS-SPME/GC-MS no
ProkaryotaEscherichia Colimilk samplesGC-MS(BPX-5)no
ProkaryotaStaphylococcus Aureusmilk samplesGC-MS(BPX-5)no
EukaryotaTuber Aestivumn/aGas chromatography-olfactometry (GC-O)no
EukaryotaTuber Melanosporumn/aGas chromatography-olfactometry (GC-O)no
ProkaryotaBacillus AmyloliquefaciensTryptic soy agarSPME coupled with GC-MSno
ProkaryotaBacillus SubtilisTryptic soy agarSPME coupled with GC-MSno
ProkaryotaPaenibacillus PolymyxaTryptic soy agarSPME coupled with GC-MSno
ProkaryotaStaphylococcus AureusMilkHS-SPME/GC-MS no
ProkaryotaEscherichia ColiMilkHS-SPME/GC-MS no
ProkaryotaStaphylococcus Sciuri864 liquid mediumSPME-GC/MSno
ProkaryotaBacillus AmyloliquefaciensM9AGC/MSno
ProkaryotaLactobacillus RhamnosusMan Rogosa Sharpe broth (MRS)Tenax-trap/GC-MSno
ProkaryotaLactobacillus Rhamnosuscurd-based broth mediumGC/MSyes
EukaryotaTuber BorchiinaSPME-GC/MS/O); GC-Ryes
ProkaryotaStaphylococcus Sp.n/an/ano
ProkaryotaPaenibacillus PolymyxaGC-MS / SPMEno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.Schaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
Bacillus Thuringiensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Toyonensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Safensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Saccharomyces Cerevisiaesea buckthorn juiceHS-SPME-GC–MS/UHPLC–MSno
Staphylococcus Aureusraw Shiyang chickenHS-GC-IMS/HS-SPME-GC-MSno


3-hydroxybutan-2-one

Mass-Spectra

Compound Details

Synonymous names
acetoin
3-hydroxy-2-butanone
513-86-0
3-hydroxybutan-2-one
acetylmethylcarbinol
Dimethylketol
Acetyl methyl carbinol
2-Butanone, 3-hydroxy-
2,3-Butanolone
2-Hydroxy-3-butanone
1-Hydroxyethyl methyl ketone
Methanol, acetylmethyl-
Acetoin (natural)
gamma-Hydroxy-beta-oxobutane
3-hydroxyl-2-butanone
FEMA No. 2008
CCRIS 2918
HSDB 974
.gamma.-Hydroxy-.beta.-oxobutane
DL-Acetoin
NSC 7609
2-Acetoin
2-Butanol-3-one
AI3-03314
(+/-)-Acetoin
2-hydroxy-3-oxobutane
BG4D34CO2H
51555-24-9
DTXSID0024399
(+/-)-3-Hydroxybutan-2-one
NSC-7609
MFCD00004521
Acethoin
Butan-2-ol-3-one
EINECS 208-174-1
UN2621
UNII-BG4D34CO2H
1-Hydroxethyl methyl ketone
acetoine
BRN 0385636
acetylmethyl-
beta-oxobutane
2-Butanone, 3-hydroxy-, (R)-
b-oxobutane
Acetoin dimer
3-Oxo-2-butanol
ACETOIN MONOMER
DI-METHYLKETOL
Methanol, acetylmethyl
3-hydroxy-2-oxobutane
2-butanone, 3-hydroxy
3-hydroxy-butan-2-one
ACETOIN (DIMER)
Acetoin (~90%)
ACETOIN [FHFI]
ACETOIN [HSDB]
3-hydroxy-butane-2-one
ACETOIN [MI]
ACETOIN (MONOMER)
Acetoin, analytical standard
Butan-2-one, 3-hydroxy-
Acetoin, >=96%, natural
2-01-00-00870 (Beilstein Handbook Reference)
BUTAN-2-0L-3-ONE
DTXCID304399
ACETOIN (DIMER) [FCC]
CHEMBL3561873
CHEBI:15688
ACETOIN (MONOMER) [FCC]
NSC7609
Acetoin, natural, >=95%, FG
ACETOIN(MAY INCLUDE DIMER)
Acetoin, >=96%, FCC, FG
(S)-3-HYDROXY-2-BUTANONE
NSC89727
Tox21_302518
LMFA12000020
NSC-89727
AKOS000121293
AKOS017278202
MCULE-5374414264
UN 2621
2-Butanone, 3-hydroxy- (8CI,9CI)
Acetoin, May exist as crystalline dimer
Acetoin (may exist as crystalline dimer)
NCGC00256914-01
2-Butanone, 3-hydroxy-, (.+/-.)-
CAS-513-86-0
PD124062
3-Hydroxybutan-2-one (may include dimer)
DB-003392
H0225
NS00011932
EN300-21639
C00466
D93492
Q223083
Q-200581
Acetyl methyl carbinol [UN2621] [Flammable liquid]
2,3,5,6- TETRAMETHYL-1,4-DIOXANE-2,5-DIOL
F0001-1338
Microorganism:

Yes

IUPAC name3-hydroxybutan-2-one
SMILESCC(C(=O)C)O
InchiInChI=1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3
FormulaC4H8O2
PubChem ID179
Molweight88.11
LogP-0.3
Atoms6
Bonds1
H-bond Acceptor2
H-bond Donor1
Chemical Classificationalcohols ketones
CHEBI-ID15688
Supernatural-IDSN0331260

mVOC Specific Details

Boiling Point
DegreeReference
148 °C peer reviewed
Volatilization
The Henry's Law constant for acetoin is estimated as 1.0X0-5 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that acetoin is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 2 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 28 days(SRC). Acetoin's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Acetoin is expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 2.7 mm Hg(SRC), determined from a fragment constant method(3).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Lyman WJ; p. 31 in Environmental Exposure From Chemicals Vol I, Neely WB, Blau GE, eds, Boca Raton, FL: CRC Press (1985)
Soil Adsorption
The Koc of acetoin is estimated as 2(SRC), using a water solubility of 1.0X10+6 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that aetoin is expected to have very high mobility in soil.
Literature: (1) Yalkowsky SH, Dannenfelser RM; The AQUASOL DATABASE of Aqueous Solubility. Ver 5. Tucson, AZ: Univ AZ, College of Pharmacy (1992) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-5 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
2.7X10+0 at 25 deg C /Estimated/US EPA; Estimation Program Interface (EPI) Suite. Ver.3.11. June 10, 2003. Available from, as of Mar 15, 2005: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaProteus MirabilisNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PyogenesNANAThorn et al. 2011
EukaryotaCandida ParapsilosisNANAFitzgerald et al. 2022
ProkaryotaEscherichia ColiNANAFitzgerald et al. 2021
ProkaryotaPseudomonas AeruginosaNANAFitzgerald et al. 2021
ProkaryotaStaphylococcus AureusNANAFitzgerald et al. 2021
ProkaryotaKlebsiella PneumoniaeNANARees et al. 2016a
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
ProkaryotaStreptococcus PneumoniaeNANAMellors et al. 2018
ProkaryotaEscherichia ColiNANADixon et al. 2022
ProkaryotaStaphylococcus AureusNANAZechman et al. 1986
ProkaryotaStaphylococcus AureusNANAFilipiak et al. 2012
ProkaryotaStaphylococcus Epidermidisclinical isolate,catheterLemfack et al. 2016
ProkaryotaStaphylococcus Haemolyticusclinical isolate,human skinLemfack et al. 2016
ProkaryotaStaphylococcus Saccharolyticusclinical isolateLemfack et al. 2016
ProkaryotaStaphylococcus Schleifericlinical isolateLemfack et al. 2016
ProkaryotaStaphylococcus Warnericlinical isolate,human skinLemfack et al. 2016
ProkaryotaErwinia AmylovoraNACellini et al. 2018
ProkaryotaEscherichia ColiChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
ProkaryotaListeria MonocytogenesChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
ProkaryotaShigella FlexneriChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
ProkaryotaStaphylococcus AureusChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et al. 2017
ProkaryotaBacillus Sp.KX395632.1Fincheira et al. 2017
EukaryotaTrichoderma Harzianum0NALi et al. 2018
ProkaryotaBacillus AmyloliquefaciensInhibition of fusarium oxysporum f.sp. Niveum; fresh weight of Arabidopsis seedlings increasedrhizosphere soils of watermelon plantsWu et al. 2019
ProkaryotaBacillus Amyloliquefaciens0rhizosphere soils of watermelon plantsWu et al. 2019
EukaryotaTrichoderma HarzianumNALi et al. 2018
ProkaryotaBacillus Subtilisantibacterial activity against growth of Ralstonia solanacearumPlant Bacteriology Lab, Division of Plant Pathology, Indian Council of Agricultural Research - Indian Agricultural Research Institute, New DelhiKashyap et al. 2022
ProkaryotaPseudomonas Fluorescensantibacterial activity against growth of Ralstonia solanacearumPlant Bacteriology Lab, Division of Plant Pathology, Indian Council of Agricultural Research - Indian Agricultural Research Institute, New DelhiKashyap et al. 2022
ProkaryotaBacillus Tequilensisantifungal activity against the hyphae growth of Ceratocystis fimbriatarhizosphere soil of a sweet potato variety (Xushu-36) from Xuzhou Academy of Agricultural Sciences in China in 2016Xu et al. 2021
ProkaryotaPaenibacillus PolymyxaNAMülner et al. 2021
EukaryotaAspergillus FlavusITEM collection of CNR-ISPA (Research National Council of Italy - Institute of Sciences of Food Production) in Bari, ItalyJosselin et al. 2021
ProkaryotaBacillus Amyloliquefaciensstimulate growth of Solanum tuberosumcommercial strainHeenan-Daly et al. 2021
ProkaryotaBacillus Toyonensisstimulate growth of Solanum tuberosumisolate from Irish potato soilsHeenan-Daly et al. 2021
ProkaryotaBacillus Mycoidesstimulate growth of Solanum tuberosumisolate from Irish potato soilsHeenan-Daly et al. 2021
ProkaryotaSerratia Myotisisolate from Irish potato soilsHeenan-Daly et al. 2021
ProkaryotaStaphylococcus AureusLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaEscherichia ColiLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaStaphylococcus Epidermidisstrains were provided by Prof. O'Gara at NUI GalwayFitzgerald et al. 2020
ProkaryotaBacillus Sp.antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants)NALópez et al. 2021
ProkaryotaBacillus AmyloliquefaciensNAMülner et al. 2020
ProkaryotaBacillus Velezensisgrowth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize)Leibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHMülner et al. 2020
ProkaryotaBacillus Velezensisgrowth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize)NAMülner et al. 2020
ProkaryotaBacillus VelezensisNAMülner et al. 2020
ProkaryotaBacillus PumilusNAMülner et al. 2020
EukaryotaFusarium OxysporumNAMoisan et al. 2021
ProkaryotaBacillus Velezensisinhibite the growth of Botrytis cinerea VG1, Monilinia fructicola VG 104, Monilinia laxa VG 105, Penicillium digitatum VG 20, Penicillium expansum CECT 20140, Penicillium italicum VG 103NACalvo et al. 2020
ProkaryotaBacillus Velezensisinhibite the growth of Botrytis cinerea VG1, Monilinia fructicola VG 104, Monilinia laxa VG 105, Penicillium digitatum VG 20, Penicillium expansum CECT 20140, Penicillium italicum VG 112NACalvo et al. 2020
ProkaryotaStaphylococcus AureusNational Collections of Industrial Food and Marine Bacteria, American Type Culture Collection, Southmead HospitalSlade et al. 2022
EukaryotaGrosmannia ClavigeraNorthern Forestry Centre Culture Collection (Edmonton, Alberta), originally cultured from the phloem of MPB-infested lodgepole pine trees near Banff, AlbertaWang et al. 2020
EukaryotaOphiostoma Ipsisolated from bark beetle galleries in lodgepole pineWang et al. 2020
ProkaryotaBacillus Subtilispromote biomass production of Arabidopsis thalianarhizosphere of Haloxylon ammodendronHe et al. 2023
ProkaryotaCollimonas Fungivoransn/aNAGarbeva et al. 2014
ProkaryotaCollimonas Pratensisn/aNAGarbeva et al. 2014
ProkaryotaSerratia Sp.n/aNABruce et al. 2004
EukaryotaTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaLaccaria Bicolorn/aNAMueller et al. 2013
EukaryotaPaxillus Involutusn/aNAMueller et al. 2013
EukaryotaStropharia Rugosoannulatan/aNAMueller et al. 2013
EukaryotaTrichoderma Viriden/aNAMueller et al. 2013
ProkaryotaStaphylococcus Aureusn/aNAPreti et al. 2009
ProkaryotaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
ProkaryotaStaphylococcus Sciurinafrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al. 2011
ProkaryotaBacillus Subtilistriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al. 2004
ProkaryotaBacillus Amyloliquefacienstriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al. 2004
ProkaryotaLactobacillus RhamnosusnanaPogačić et al. 2016
EukaryotaPleurotus EryngiinanaUsami et al. 2014
EukaryotaTuber BorchiinanaSplivallo and Ebeler 2015
EukaryotaTuber IndicumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b
ProkaryotaBacillus Cereusn/aNABlom et al. 2011
ProkaryotaBurkholderia Graminisn/aNABlom et al. 2011
ProkaryotaBurkholderia Tropican/aNABlom et al. 2011
ProkaryotaChromobacterium Violaceumn/aNABlom et al. 2011
ProkaryotaLimnobacter Thiooxidansn/aNABlom et al. 2011
ProkaryotaPandoraea Norimbergensisn/aNABlom et al. 2011
ProkaryotaPseudomonas Chlororaphisn/aNABlom et al. 2011
ProkaryotaSerratia Entomophilan/aNABlom et al. 2011
ProkaryotaSerratia Marcescensn/aNABlom et al. 2011
ProkaryotaSerratia Plymuthican/aNABlom et al. 2011
ProkaryotaSerratia Proteamaculansn/aNABlom et al. 2011
ProkaryotaStenotrophomonas Rhizophilan/aNABlom et al. 2011
EukaryotaCandida Shehataecacti, fruits, insects, natural habitatsNout and Bartelt 1998
ProkaryotaEnterobacter AgglomeransNARobacker and Lauzon 2002
ProkaryotaBacillus Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
ProkaryotaEnterobacter Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
ProkaryotaKlebsiella Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
ProkaryotaSerratia Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
ProkaryotaStaphylococcus Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
ProkaryotaStreptomyces Sp.It is an attractant to Anastrepha ludens (Diptera).NASchulz and Dickschat 2007
EukaryotaBoletus Variegatusn/aNAStotzky and Schenck 1976
ProkaryotaClostridium Sp.n/aNAStotzky and Schenck 1976
ProkaryotaBacillus SubtilisInduce growth promotion (leaf surface area), systemic resistance (ISR) and regulate auxin homeostasis in Arabidopsis thaliana.NARyu et al. 2003
ProkaryotaBacillus AmyloliquefaciensInduce growth promotion (leaf surface area), systemic resistance (ISR) and regulate auxin homeostasis in Arabidopsis thaliana.NARyu et al. 2003
ProkaryotaLactobacillus Casein/aNATracey and Britz 1989
ProkaryotaLactobacillus Plantarumn/aNATracey and Britz 1989
ProkaryotaPediococcus Damnosusn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Cremorisn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Dextranicumn/aNATracey and Britz 1989
ProkaryotaLactococcus Lactisn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Mesenteroidesn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Paramesenteroidesn/aNATracey and Britz 1989
ProkaryotaOenococcus Oenin/aNATracey and Britz 1989
EukaryotaTrichoderma Viriden/aNAHung et al. 2013
ProkaryotaPaenibacillus Polymyxan/aNALee et al. 2012
ProkaryotaStaphylococcus Aureusn/aNAHettinga et al. 2008
ProkaryotaStreptococcus Uberisn/aNAHettinga et al. 2008
ProkaryotaCoagulase-negative Staphylococcin/aNAHettinga et al. 2008
ProkaryotaAzospirillum Brasilensepromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
ProkaryotaBacillus Pumiluspromotion of performance of Chlorella sorokiniana ShihNAAmavizca et al. 2017
ProkaryotaEscherichia Colipromotion of performance of Chlorella sorokiniana ShihNAAmavizca et al. 2017
ProkaryotaStreptococcus Dysgalactiaemilk of cowsHettinga et al. 2008
EukaryotaSaccharomyces Cerevisiaegrape vineBecher et al. 2012
EukaryotaFusarium VerticillioidesNADickschat et al. 2011
ProkaryotaBacillus AmyloliquefaciensnanaAsari et al. 2016
ProkaryotaPaenibacillus Polymyxacollection TU GrazRybakova et al. 2017
EukaryotaVerticillium Longisporumcollection TU GrazRybakova et al. 2017
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaCryptococcus NemorosusNANALjunggren et al. 2019
EukaryotaMetschnikowia LopburiensisNANALjunggren et al. 2019
EukaryotaMetschnikowia PulcherrimaNANALjunggren et al. 2019
EukaryotaMetschnikowia FructicolaNANALjunggren et al. 2019
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
EukaryotaAureobasidium PullulansNANAMozūraitis et al. 2022
EukaryotaCryptococcus WieringaeNANAMozūraitis et al. 2022
EukaryotaHanseniaspora UvarumNANAMozūraitis et al. 2022
EukaryotaPichia KluyveriNANAMozūraitis et al. 2022
EukaryotaSaccharomyces ParadoxusNANAMozūraitis et al. 2022
EukaryotaTorulaspora DelbrueckiiNANAMozūraitis et al. 2022
EukaryotaMetschnikowia PulcherrimaNANAMozūraitis et al. 2022
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaLactobacillus PlantarumNANAZhang et al. 2022
ProkaryotaBacillus SubtilisNANALee et al. 2023
EukaryotaMeyerozyma GuilliermondiiNANAZhao et al. 2022
EukaryotaSaturnispora DiversaNANAZhao et al. 2022
EukaryotaWickerhamomyces AnomalusNANAZhao et al. 2022
EukaryotaPhytophthora CinnamomiN/APhytophthora cinnamomiQiu R et al. 2014
EukaryotaPhytophthora PlurivoraN/APhytophthora plurivoraLoulier et al. 2020
Meyerozyma GuilliermondiiXiong et al. 2023
Lentinula EdodesGeng et al. 2024
Lactiplantibacillus PlantarumChen et al. 2023
Lactobacillus PlantarumZhang et al. 2023
Bacillus ThuringiensisKoilybayeva et al. 2023
Bacillus ToyonensisKoilybayeva et al. 2023
Bacillus AcidiproducensKoilybayeva et al. 2023
Bacillus CereusKoilybayeva et al. 2023
Bacillus SafensisKoilybayeva et al. 2023
Enterobacter AgglomeransTallon et al. 2023
Saccharomyces CerevisiaePeng et al. 2023
Staphylococcus AureusWang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStreptococcus PyogenesTYESIFT-MSno
EukaryotaCandida ParapsilosisYPDSPME/GC-MSno
EukaryotaCandida ParapsilosisTSBSPME/GC-MSno
ProkaryotaEscherichia ColiTSBSPME/GC-MSno
ProkaryotaEscherichia ColiBHISPME/GC-MSno
ProkaryotaPseudomonas AeruginosaBHISPME/GC-MSno
ProkaryotaStaphylococcus AureusTSBSPME/GC-MSno
ProkaryotaStaphylococcus AureusBHISPME/GC-MSno
ProkaryotaStaphylococcus AureusLBSPME/GC-MSno
ProkaryotaKlebsiella Pneumoniaehuman bloodSPME/GCxGC-MSno
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
ProkaryotaStreptococcus PneumoniaeModified Lacks MediaSPME/GCxGC-MSno
ProkaryotaEscherichia ColiLBTD/GC-MSno
ProkaryotaStaphylococcus AureusTSBTD/GC-MSno
ProkaryotaStaphylococcus Aureustryptic soy brothTD/GC-MSno
ProkaryotaStaphylococcus Epidermidisbrain heart infusion mediumPorapak / GC/MSno
ProkaryotaStaphylococcus Haemolyticusbrain heart infusion mediumPorapak / GC/MSno
ProkaryotaStaphylococcus Saccharolyticusbrain heart infusion mediumPorapak / GC/MSno
ProkaryotaStaphylococcus Schleiferibrain heart infusion mediumPorapak / GC/MSno
ProkaryotaStaphylococcus Warneribrain heart infusion mediumPorapak / GC/MSno
ProkaryotaErwinia AmylovoraLuria-Bertani (LB)PTR-MS / SPME / GC-MSno
ProkaryotaEscherichia ColiTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
ProkaryotaListeria MonocytogenesTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
ProkaryotaShigella FlexneriTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusTrypticase Soy Broth (TSB)HS-SPME/GC-MSno
ProkaryotaBacillus Sp.Plate Count agar (PCA)GC–MSyes
ProkaryotaBacillus Sp.Methyl Red & Voges Proskauer broth (MRVP-B)SPME, GC-MSyes
EukaryotaTrichoderma HarzianumPDA plateSPME-GC-MSno
ProkaryotaBacillus Amyloliquefaciensmodified Murashige-Skoog (MS) culture mediumSPME-GC-MSno
EukaryotaTrichoderma Harzianumpotato dextrose agarSPME, GC-MSno
ProkaryotaBacillus SubtilisLB agarGC-MSno
ProkaryotaPseudomonas FluorescensLB agarGC-MSno
ProkaryotaBacillus TequilensisLB mediaHS-SPME/GC-MSno
ProkaryotaPaenibacillus PolymyxaNA media, LB media, TSA mediaHS-SPME/GC-MSno
ProkaryotaPaenibacillus PolymyxaNA media, LB media, TSA media, Landy mediaHS-SPME/GC-MSno
EukaryotaAspergillus FlavusSNA mediaSPME/GC-MSno
ProkaryotaBacillus AmyloliquefaciensTSB media, MR-VP (Methyl Red-Vogos Proskeur) mediaSPME/GC-MSno
ProkaryotaBacillus ToyonensisTSB media, MR-VP (Methyl Red-Vogos Proskeur) media, M+S (Murashige and Skoog) mediaSPME/GC-MSno
ProkaryotaBacillus MycoidesTSB media, MR-VP (Methyl Red-Vogos Proskeur) mediaSPME/GC-MSno
ProkaryotaSerratia MyotisTSB mediaSPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaEscherichia ColiTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus EpidermidisTSB mediaHS-SPME/GC-MSno
ProkaryotaBacillus Sp.TYB mediaGC-MSno
ProkaryotaBacillus Amyloliquefaciensnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Velezensisnutrient agarHS-SPME/GC-MSno
ProkaryotaBacillus Pumilusnutrient agarHS-SPME/GC-MSno
EukaryotaFusarium Oxysporum1/5th PDA mediumGC-MSno
ProkaryotaBacillus VelezensisMOLP mediaSPME/GC-MSyes
ProkaryotaStaphylococcus AureusTS agar/blood agarHS-SPME/GC-MSno
EukaryotaGrosmannia ClavigeraPDA mediaGC-MSno
EukaryotaOphiostoma IpsPDA mediaGC-MSno
ProkaryotaBacillus Subtilis1/2 MS mediaSPME/GC-MSno
ProkaryotaCollimonas Fungivoranssand supplemented with artificial root exudatesHeadspace trapping/GC-MSno
ProkaryotaCollimonas Pratensissand supplemented with artificial root exudatesHeadspace trapping/GC-MSno
ProkaryotaSerratia Sp.n/an/ano
EukaryotaTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MSno
EukaryotaLaccaria BicolorMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaPaxillus InvolutusMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaStropharia RugosoannulataMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaTrichoderma VirideMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
ProkaryotaStaphylococcus AureusBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
ProkaryotaStaphylococcus Sciuri867 liquid mediumSPME-GC/MSno
ProkaryotaBacillus SubtilisMurashige and Skoog mediumcapillary GC;GC/MSyes
ProkaryotaBacillus AmyloliquefaciensMurashige and Skoog mediumcapillary GC;GC/MSyes
ProkaryotaLactobacillus Rhamnosuscurd-based broth mediumGC/MSyes
EukaryotaPleurotus EryngiinaGC/MS, GC-O, AEDAno
EukaryotaTuber BorchiinaSPME-GC/MS/O); GC-Ryes
EukaryotaTuber Indicumyes
ProkaryotaBacillus CereusMR-VP and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia GraminisMSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaBurkholderia TropicaMR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaChromobacterium ViolaceumMR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaLimnobacter Thiooxidans MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPandoraea NorimbergensisMSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaPseudomonas Chlororaphis MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaSerratia Entomophila MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaSerratia MarcescensLB, MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaSerratia PlymuthicaMR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaSerratia ProteamaculansLB, MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
ProkaryotaStenotrophomonas Rhizophila MR-VP and LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)no
EukaryotaCandida Shehataeyeast malt agarSPME, GC-MSyes
ProkaryotaEnterobacter Agglomeransno
ProkaryotaBacillus Sp.n/an/ano
ProkaryotaEnterobacter Sp.n/an/ano
ProkaryotaKlebsiella Sp.n/an/ano
ProkaryotaStaphylococcus Sp.n/an/ano
ProkaryotaStreptomyces Sp.n/an/ano
EukaryotaBoletus Variegatusn/an/ano
ProkaryotaClostridium Sp.n/an/ano
ProkaryotaBacillus Subtilisn/an/ano
ProkaryotaBacillus Amyloliquefaciensn/an/ano
ProkaryotaLactobacillus Casein/an/ano
ProkaryotaLactobacillus Plantarumn/an/ano
ProkaryotaPediococcus Damnosusn/an/ano
ProkaryotaLeuconostoc Cremorisn/an/ano
ProkaryotaLeuconostoc Dextranicumn/an/ano
ProkaryotaLactococcus Lactisn/an/ano
ProkaryotaLeuconostoc Mesenteroidesn/an/ano
ProkaryotaLeuconostoc Paramesenteroidesn/an/ano
ProkaryotaOenococcus Oenin/an/ano
EukaryotaTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSno
ProkaryotaPaenibacillus PolymyxaTryptic soy agarSPME coupled with GC-MSno
ProkaryotaStaphylococcus AureusMilkHS-SPME/GC-MS no
ProkaryotaStreptococcus UberisMilkHS-SPME/GC-MS no
ProkaryotaCoagulase-negative StaphylococciMilkHS-SPME/GC-MS no
ProkaryotaAzospirillum BrasilenseTSASPME-GCno
ProkaryotaBacillus PumilusTSASPME-GCno
ProkaryotaEscherichia ColiTSASPME-GCno
ProkaryotaStreptococcus DysgalactiaeGCMS DSQno
EukaryotaSaccharomyces Cerevisiaesynthetic minimal mediumGC-MS, EIyes
EukaryotaFusarium Verticillioidesno
ProkaryotaBacillus AmyloliquefaciensM9AGC/MSno
ProkaryotaPaenibacillus PolymyxaGC-MS / SPMEno
EukaryotaVerticillium Longisporumpotato dextrose agar (PDA), Czapek Dox liquid cultureGC-MS / SPMEno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaCryptococcus Nemorosusliquid YPD mediumGC-MSno
EukaryotaMetschnikowia Lopburiensisliquid YPD mediumGC-MSno
EukaryotaMetschnikowia Pulcherrimaliquid YPD mediumGC-MSno
EukaryotaMetschnikowia Fructicolaliquid YPD mediumGC-MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
EukaryotaAureobasidium PullulansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaCryptococcus WieringaeYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaHanseniaspora UvarumYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KluyveriYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaSaccharomyces ParadoxusYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaTorulaspora DelbrueckiiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaMetschnikowia PulcherrimaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPseudomonas SegetisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisSchaeffer’s growth (SG) mediumHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaLactobacillus Plantarumchickpea milkUHPLC/MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno
EukaryotaMeyerozyma Guilliermondiisynthetic grape juiceHS-SPMEno
EukaryotaSaturnispora Diversasynthetic grape juiceHS-SPMEno
EukaryotaWickerhamomyces Anomalussynthetic grape juiceHS-SPMEno
EukaryotaPhytophthora CinnamomiPotato Dextrose Agar,V8 juice agarSPME/GC-MS/MSno
EukaryotaPhytophthora PlurivoraPotato Dextrose AgarSPME/GC-MS/MSstandard
Meyerozyma GuilliermondiiYEPD, 10 g/L yeast extrac, 20 g/L peptone, 20 g dextroseGC-MS and GC-IMSno
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno
Lactiplantibacillus Plantarumfermentation of ginkgo kernel juiceGC-IMSno
Lactobacillus PlantarumHabanero pepperGC–IMSno
Bacillus Thuringiensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Toyonensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Acidiproducensbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Cereusbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Safensisbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Enterobacter Agglomeranstryptone soya broth (TSB) mediaSPME/GC/MSno
Saccharomyces Cerevisiaesea buckthorn juiceHS-SPME-GC–MS/UHPLC–MSno
Staphylococcus Aureusraw Shiyang chickenHS-GC-IMS/HS-SPME-GC-MSno


Butanoic Acid

Mass-Spectra

Compound Details

Synonymous names
butyric acid
butanoic acid
107-92-6
n-Butyric acid
n-Butanoic acid
propylformic acid
ethylacetic acid
1-propanecarboxylic acid
butyrate
Butanic acid
1-Butyric acid
Buttersaeure
butanoate
Butyric acid (natural)
Kyselina maselna
FEMA No. 2221
Propanecarboxylic acid
1-butanoic acid
acide butyrique
butoic acid
Buttersaeure [German]
Butyricum acidum
FEMA Number 2221
CCRIS 6552
HSDB 940
Kyselina maselna [Czech]
NSC 8415
fattyacids
67254-79-9
acide butanoique
2-butanoate
NORMAL BUTYRIC ACID
AI3-15306
NSC-8415
EINECS 203-532-3
UNII-40UIR9Q29H
MFCD00002814
UN2820
Butyric--d4 Acid
BRN 0906770
40UIR9Q29H
C4:0
DTXSID8021515
CHEBI:30772
Acid, Butanoic
NSC8415
BUTYRIC ACID (D8)
CH3-[CH2]2-COOH
DTXCID401515
EC 203-532-3
butanate
4-02-00-00779 (Beilstein Handbook Reference)
Butyrate sodium
1-butanoate
propanecarboxylate
1-butyrate
Butyric acid [UN2820] [Corrosive]
Sodium n-butyrate
1-propanecarboxylate
BUA
CH3-(CH2)2-COOH
Butyric Acid (Normal)
Acid, Butyric
CAS-107-92-6
sodium-butyrate
Honey robber
Tetranoic Acid
ethyl acetic acid
1ugp
3umq
butanoic acid, 4
TNFa + NaBut
715 - Chocolate
Butyrate, sodium salt
Butyric acid [UN2820] [Corrosive]
BUTYRIC_ACID
n-C3H7COOH
TNFa + Sodium Butyrate
Butyric acid, >=99%
bmse000402
BUTYRIC ACID [MI]
NCIMech_000707
BUTYRIC ACID [FCC]
WLN: QV3
BUTYRIC ACID [HSDB]
BUTYRIC ACID [INCI]
BUTYRIC ACID [VANDF]
CHEMBL14227
BUTYRIC ACID [WHO-DD]
Butyric acid, >=99%, FG
N-BUTYRIC ACID [FHFI]
GTPL1059
BUTYRICUM ACIDUM [HPUS]
BDBM26109
Butyric acid, analytical standard
Bio1_000444
Bio1_000933
Bio1_001422
STR06290
Tox21_202382
Tox21_300164
CCG-35836
FA 4:0
LMFA01010004
STL169349
AKOS000118961
DB03568
MCULE-4116382006
UN 2820
NCGC00247914-01
NCGC00247914-02
NCGC00247914-05
NCGC00253919-01
NCGC00259931-01
BP-21420
NCI60_001424
Butyric acid, natural, >=99%, FCC, FG
DB-318878
B0754
NS00001284
Butyric acid 1000 microg/mL in Acetonitrile
Butyric acid, SAJ special grade, >=99.5%
EN300-21334
C00246
Q193213
W-108732
BRD-K05878375-236-02-4
9B27B3D0-9643-40EC-9A5F-7CA1A6ED7F9F
F2191-0094
Z104495380
InChI=1/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6
Microorganism:

Yes

IUPAC namebutanoic acid
SMILESCCCC(=O)O
InchiInChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)
FormulaC4H8O2
PubChem ID264
Molweight88.11
LogP0.8
Atoms6
Bonds2
H-bond Acceptor2
H-bond Donor1
Chemical Classificationacids carboxylic acids
CHEBI-ID30772
Supernatural-IDSN0083680

mVOC Specific Details

Boiling Point
DegreeReference
163.5 °C peer reviewed
Volatilization
The Henry's Law constant for n-butanoic acid is measured as 5.35X10-7 atm-cu m/mole(1). This Henry's Law constant indicates that n-butanoic acid is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 64 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 471 days(SRC). A pKa of 4.82(3) indicates n-butanoic acid will exist almost entirely in the anion form at pH values of 5 to 9 and therefore volatilization from water surfaces is not expected to be an important fate process(4). n-Butanoic acid's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). n-Butanoic acid is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 1.65 mm Hg(5).
Literature: (1) Butler JAV, Ramchandani CN; The Solubility of Non-Electrolytes. Part 2. J Chem Soc pp. 1952-5 (1935) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Riddick JA et al; Organic Solvents. Techniques of Chemistry 4th ed. New York, NY, Wiley-Interscience 2 pp. 1325 (1986) (4) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000) (5) Lide DR, ed; CRC Handbook of Chemistry and Physics. 76th ed. Boca Raton, FL: CRC Press (1995)
Soil Adsorption
The Koc of n-butanoic acid is estimated as 64(SRC), using a log Kow of 0.79(1) and a regression-derived equation(2). Experimental Koc values for n-butanoic acid on a clastic mud (3.5% organic carbon), a lateritic muddy sand (1.3% organic carbon), and a fine carbonate sand (0.17% organic carbon) were 19.1, 27.6, and 14.7, respectively(3). According to a classification scheme(4), these estimated and experimental Koc values suggest that n-butanoic acid is expected to have very high to high mobility in soil. The percent of n-butanoic acid sorbed to a kalonite or montmorillonite clay at 22 deg C was 14.0% and 19.9% after 48 hours, respectively, which increased to 31.4% and 24.2%, respectively, after 144 hours(5). In a field study in which 100 ppm n-butanoic acid was injected underground, the retardation, relative to the linear ground-water velocity, was calculated to be 3%(6). N-butanoic acid is listed as a compound displaying an L-type adsorption isotherm, indicating that specific binding sites may be involved(7). Experimental studies in indicate that adsorption of n-butanoic acid to moist soil is dominated by attractive forces between the compound and soil and not by hydrophobic interactions(8). The pKa of n-butanoic acid is 4.82(9), indicating that this compound will primarily exist in the anion in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(10).
Literature: (1) Sansone FJ et al; Geochim Cosmochim Acta 51: 1889-96 (1987) (2) Swann RL et al; Res Rev 85: 17-28 (1983) (3) Hemphill L et al; Proc 18th Indust Waste Conf 18: 204-17 (1964) (4) Sutton PA, Barker JF; Ground Water 23: 10-6 (1985) (5) Weber JB, Miller CT; Reactions and Movement of Organic Chemicals in Soils, SSSA Spec Publ No. 22: 305-33 (1989) (6) Ulrich H et al; Env Sci Tech 22: 37-41 (1988) (7) Riddick JA et al; Organic Solvents. Techniques of Chemistry 4th ed. New York, NY, Wiley-Interscience 2:pp. 1325 (1986) (8) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Vapor Pressure
PressureReference
1.65 mm Hg at 25 deg CLide, D.R. (ed.). CRC Handbook of Chemistry and Physics. 76th ed. Boca Raton, FL: CRC Press Inc., 1995-1996., p. 6-85
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANALu et al. 2022
ProkaryotaBurkholderia CepaciaNANAThorn et al. 2011
ProkaryotaBurkholderia CepaciaNANADryahina et al. 2016
ProkaryotaEscherichia ColiNANAThorn et al. 2011
ProkaryotaProteus MirabilisNANAThorn et al. 2011
ProkaryotaPseudomonas AeruginosaNANADryahina et al. 2016
ProkaryotaStaphylococcus AureusNANAThorn et al. 2011
ProkaryotaStaphylococcus AureusNANADryahina et al. 2016
ProkaryotaStenotrophomonas MaltophiliaNANADryahina et al. 2016
ProkaryotaStreptococcus PyogenesNANAThorn et al. 2011
ProkaryotaEscherichia ColiNANAHewett et al. 2020
EukaryotaSaccharomyces CerevisiaeNATejero Rioseras et al. 2017
ProkaryotaStaphylococcus AureusChina Center of Industrial Culture collectionWang et al. 2018
ProkaryotaStaphylococcus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaLactobacillus Casein/aNATracey and Britz 1989
ProkaryotaLactobacillus Plantarumn/aNATracey and Britz 1989
ProkaryotaPediococcus Damnosusn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Cremorisn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Dextranicumn/aNATracey and Britz 1989
ProkaryotaLactococcus Lactisn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Mesenteroidesn/aNATracey and Britz 1989
ProkaryotaLeuconostoc Paramesenteroidesn/aNATracey and Britz 1989
ProkaryotaOenococcus Oenin/aNATracey and Britz 1989
ProkaryotaEscherichia Colin/aNATait et al. 2014
ProkaryotaKlebsiella Pneumoniaen/aNATait et al. 2014
ProkaryotaStaphylococcus Aureusn/aNATait et al. 2014
ProkaryotaStaphylococcus Sciuriinduced E. balteatus ovipositionfrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al. 2011
ProkaryotaLactobacillus ParacaseinaMajorero cheesePogačić et al. 2016
ProkaryotaClostridium Difficileoutbreak 2006 UKRees et al. 2016
EukaryotaTuber Aestivumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
EukaryotaTuber Melanosporumn/aT. melanosporum was from the cultivated truffle zones in the province and T. aestivum from the natural truffle zones in the same regionCullere et al. 2010
ProkaryotaClostridium Sp.n/aNAStotzky and Schenck 1976
ProkaryotaPorphyromonas GingivalisInhibition of proliferation and cytokine production in Lymphocyte cells.NAKurita-Ochiai et al. 1995
ProkaryotaPrevotella LoescheiiInhibition of proliferation and cytokine production in Lymphocyte cells.NAKurita-Ochiai et al. 1995
ProkaryotaFusobacterium NucleatumInhibition of proliferation and cytokine production in Lymphocyte cells.NAKurita-Ochiai et al. 1995
ProkaryotaClostridium Cadaverumn/aNAWiggins et al. 1985
ProkaryotaClostridium Tertiumn/aNAWiggins et al. 1985
ProkaryotaClostridium Fallaxn/aNAWiggins et al. 1985
ProkaryotaClostridium Butyricumn/aNAWiggins et al. 1985
ProkaryotaClostridium Sporogenesn/aNAWiggins et al. 1985
ProkaryotaPorphyromonas Gingivalisn/aNAKurita-Ochiai et al. 1995
ProkaryotaPrevotella Loescheiin/aNAKurita-Ochiai et al. 1995
ProkaryotaPrevotella Intermedian/aNAKurita-Ochiai et al. 1995
ProkaryotaFusobacterium Nucleatumn/aNAKurita-Ochiai et al. 1995
ProkaryotaActinomyces Naeslundiiclinical exudatesJulak et al. 2003
ProkaryotaClostridium Bifermentansclinical exudatesJulak et al. 2003
ProkaryotaClostridium Perfringensclinical exudatesJulak et al. 2003
ProkaryotaClostridium Septicumclinical exudatesJulak et al. 2003
ProkaryotaEnterobacter Cloacaeclinical exudatesJulak et al. 2003
ProkaryotaEubacterium Lentumclinical exudatesJulak et al. 2003
ProkaryotaFusobacterium Simiaeclinical exudatesJulak et al. 2003
ProkaryotaFusobacterium Necrophorumclinical exudatesJulak et al. 2003
ProkaryotaLactobacillus Acidophilusclinical exudatesJulak et al. 2003
ProkaryotaPeptococcus Nigerclinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Anaerobiusclinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Asaccharolyticusclinical exudatesJulak et al. 2003
ProkaryotaPeptostreptococcus Prevotiiclinical exudatesJulak et al. 2003
EukaryotaCandida Albicansclinical exudatesJulak et al. 2003
ProkaryotaEscherichia Colimilk of cowsHettinga et al. 2008
ProkaryotaStreptococcus Dysgalactiaemilk of cowsHettinga et al. 2008
ProkaryotaCoagulase-negative Staphylococcimilk of cowsHettinga et al. 2008
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
EukaryotaSaccharomyces CerevisiaeNANAGe et al. 2021
EukaryotaAureobasidium PullulansNANAMozūraitis et al. 2022
EukaryotaCryptococcus WieringaeNANAMozūraitis et al. 2022
EukaryotaHanseniaspora UvarumNANAMozūraitis et al. 2022
EukaryotaPichia KudriavzeviiNANAMozūraitis et al. 2022
EukaryotaPichia FermentansNANAMozūraitis et al. 2022
EukaryotaPichia KluyveriNANAMozūraitis et al. 2022
EukaryotaPichia MembranifaciensNANAMozūraitis et al. 2022
EukaryotaSaccharomyces ParadoxusNANAMozūraitis et al. 2022
EukaryotaTorulaspora DelbrueckiiNANAMozūraitis et al. 2022
EukaryotaPichia AnomalaNANAMozūraitis et al. 2022
EukaryotaMetschnikowia PulcherrimaNANAMozūraitis et al. 2022
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaLactobacillus PlantarumNANAZhang et al. 2022
EukaryotaMeyerozyma GuilliermondiiNANAZhao et al. 2022
EukaryotaSaturnispora DiversaNANAZhao et al. 2022
EukaryotaWickerhamomyces AnomalusNANAZhao et al. 2022
Bacillus AcidiproducensKoilybayeva et al. 2023
Bacillus CereusKoilybayeva et al. 2023
Debaryomyces HanseniiLi et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaTH mediumGC-IMSno
ProkaryotaBurkholderia CepaciaTYESIFT-MSno
ProkaryotaBurkholderia CepaciaBHISIFT-MSno
ProkaryotaBurkholderia CepaciaMHBSIFT-MSno
ProkaryotaBurkholderia CepaciaNBSIFT-MSno
ProkaryotaEscherichia ColiTYESIFT-MSno
ProkaryotaProteus MirabilisTYESIFT-MSno
ProkaryotaPseudomonas AeruginosaNBSIFT-MSno
ProkaryotaPseudomonas AeruginosaBHISIFT-MSno
ProkaryotaPseudomonas AeruginosaMHBSIFT-MSno
ProkaryotaStaphylococcus AureusTYESIFT-MSno
ProkaryotaStaphylococcus AureusMHBSIFT-MSno
ProkaryotaStaphylococcus AureusNBSIFT-MSno
ProkaryotaStaphylococcus AureusBHISIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaNBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaMHBSIFT-MSno
ProkaryotaStenotrophomonas MaltophiliaBHISIFT-MSno
ProkaryotaStreptococcus PyogenesTYESIFT-MSno
ProkaryotaEscherichia ColiLBSPME/GC-MSno
EukaryotaSaccharomyces Cerevisiaeyeast nitrogen base, 2% glucoseSESI-HRMSno
ProkaryotaStaphylococcus AureusSodium chloride brothSPME, GC-MSno
ProkaryotaStaphylococcus Sp.n/an/ano
ProkaryotaLactobacillus Casein/an/ano
ProkaryotaLactobacillus Plantarumn/an/ano
ProkaryotaPediococcus Damnosusn/an/ano
ProkaryotaLeuconostoc Cremorisn/an/ano
ProkaryotaLeuconostoc Dextranicumn/an/ano
ProkaryotaLactococcus Lactisn/an/ano
ProkaryotaLeuconostoc Mesenteroidesn/an/ano
ProkaryotaLeuconostoc Paramesenteroidesn/an/ano
ProkaryotaOenococcus Oenin/an/ano
ProkaryotaEscherichia ColiBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Columnno
ProkaryotaKlebsiella PneumoniaeBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Columnno
ProkaryotaStaphylococcus AureusBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Columnno
ProkaryotaStaphylococcus Sciuri872 liquid mediumSPME-GC/MSno
ProkaryotaLactobacillus Paracaseicurd-based broth mediumGC/MSyes
ProkaryotaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
EukaryotaTuber Aestivumn/aGas chromatography-olfactometry (GC-O)no
EukaryotaTuber Melanosporumn/aGas chromatography-olfactometry (GC-O)no
ProkaryotaClostridium Sp.n/an/ano
ProkaryotaPorphyromonas Gingivalisn/an/ano
ProkaryotaPrevotella Loescheiin/an/ano
ProkaryotaFusobacterium Nucleatumn/an/ano
ProkaryotaClostridium Cadaverumn/an/ano
ProkaryotaClostridium Tertiumn/an/ano
ProkaryotaClostridium Fallaxn/an/ano
ProkaryotaClostridium Butyricumn/an/ano
ProkaryotaClostridium Sporogenesn/an/ano
ProkaryotaPrevotella Intermedian/an/ano
ProkaryotaActinomyces Naeslundiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Bifermentanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Perfringenspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaClostridium Septicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaEnterobacter Cloacaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaEubacterium Lentumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaFusobacterium Simiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaFusobacterium Necrophorumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaLactobacillus Acidophiluspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptococcus Nigerpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Anaerobiuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Asaccharolyticuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaPeptostreptococcus Prevotiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
EukaryotaCandida Albicanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
ProkaryotaEscherichia ColiGCMS DSQno
ProkaryotaStreptococcus DysgalactiaeGCMS DSQno
ProkaryotaCoagulase-negative StaphylococciGCMS DSQno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
EukaryotaSaccharomyces Cerevisiaegrape juiceLC-15C HPLCno
EukaryotaAureobasidium PullulansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaCryptococcus WieringaeYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaHanseniaspora UvarumYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KudriavzeviiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia FermentansYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia KluyveriYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia MembranifaciensYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaSaccharomyces ParadoxusYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaTorulaspora DelbrueckiiYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaPichia AnomalaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
EukaryotaMetschnikowia PulcherrimaYPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar)SPME-GC-MSno
ProkaryotaStaphylococcus EquorumMOLPHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaLactobacillus Plantarumchickpea milkUHPLC/MSno
EukaryotaMeyerozyma Guilliermondiisynthetic grape juiceHS-SPMEno
EukaryotaSaturnispora Diversasynthetic grape juiceHS-SPMEno
EukaryotaWickerhamomyces Anomalussynthetic grape juiceHS-SPMEno
Bacillus Acidiproducensbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Bacillus Cereusbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno
Debaryomyces Hanseniimeat with pork lardGC-MSno