Results for:
chemical Classification: azines

2-aminoguanidine

Compound Details

Synonymous names
aminoguanidine
Pimagedine
Hydrazinecarboximidamide
79-17-4
Guanyl hydrazine
2-aminoguanidine
Monoaminoguanidine
Imino semicarbazide
Aminate base
Pimagedine [INN]
GUANIDINE, AMINO-
Hydrazinecarboximidamide(9CI)
2-azanylguanidine
SCQ4EZQ113
CHEMBL225304
CHEBI:40618
Carbamimidic acid, hydrazide; Guanylhydrazine
GER-11
[3H]-Pimagedine
AGU
CCRIS 3511
EINECS 201-183-1
UNII-SCQ4EZQ113
amino guanidine
1-aminoguanidine
1-amino-guanidine
Aminoguanidine (AG)
Tocris-0787
Lopac-A-7009
Lopac-A-8835
AMINOGUANIDINE [MI]
PIMAGEDINE [MART.]
PIMAGEDINE [WHO-DD]
Lopac0_000050
Lopac0_000103
AMY873
GTPL5135
DTXSID5040964
BDBM86154
HY-B1041A
CAS_2146
NSC_2146
BDBM50207159
HSCI1_000380
STL190849
YM-585
AKOS009031153
CCG-204198
DB05383
MDL-201228
SDCCGSBI-0050039.P002
SDCCGSBI-0050091.P002
NCGC00015082-01
NCGC00015082-02
NCGC00015082-03
NCGC00015082-04
NCGC00015082-05
NCGC00015082-06
NCGC00015082-07
NCGC00015082-14
NCGC00015082-15
NCGC00024791-01
NCGC00024791-02
NCGC00024791-03
CS-0013747
NS00018672
AB00443011_04
Q409583
SR-01000075164-1
W-104265
BRD-K25114078-003-07-3
BRD-K25114078-003-08-1
Microorganism:

No

IUPAC name2-aminoguanidine
SMILESC(=NN)(N)N
InchiInChI=1S/CH6N4/c2-1(3)5-4/h4H2,(H4,2,3,5)
FormulaCH6N4
PubChem ID2146
Molweight74.09
LogP-1.5
Atoms5
Bonds0
H-bond Acceptor2
H-bond Donor3
Chemical Classificationnitrogen compounds imides hydrazines amines
CHEBI-ID40618

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus NigerKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Nigerinoculated potato samplesGC-MSno


Methylhydrazine

Compound Details

Synonymous names
METHYLHYDRAZINE
60-34-4
Hydrazine, methyl-
Methyl Hydrazine
Monomethylhydrazine
Methyl-hydrazine
1-Methylhydrazine
Metylohydrazyna
RCRA waste number P068
N-methylhydrazine
2-methylhydrazine
CH3NHNH2
MMH
UWA30B5Z1J
CHEMBL160520
DTXSID4020874
Monomethyl Hydrazine
Methylhydrazine (mono)
Metylohydrazyna [Polish]
20244-39-7
CCRIS 394
HSDB 1172
EINECS 200-471-4
UN1244
RCRA waste no. P068
UNII-UWA30B5Z1J
BRN 0635645
methyldiazane
methl hydrazine
AI3-52240
N-methyhydrazine
N-methyl hydrazine
N-methyl-hydrazine
2-methyl hydrazine
MeNHNH2
Methylhydrazine, 98%
H2NNHCH3
EC 200-471-4
METHYLHYDRAZINE [MI]
METHYLHYDRAZINE [HSDB]
BCP07836
BBL011339
BDBM50049259
STL146429
AKOS005720746
Methylhydrazine [UN1244] [Poison]
UN 1244
BP-11387
BP-30186
Methylhydrazine, purum, >=98.0% (GC)
M0558
NS00002460
InChI=1/CH6N2/c1-3-2/h3H,2H2,1H
A832701
Q417347
HDN
Microorganism:

Yes

IUPAC namemethylhydrazine
SMILESCNN
InchiInChI=1S/CH6N2/c1-3-2/h3H,2H2,1H3
FormulaCH6N2
PubChem ID6061
Molweight46.072
LogP-0.9
Atoms3
Bonds0
H-bond Acceptor2
H-bond Donor2
Chemical Classificationnitrogen compounds hydrazines

mVOC Specific Details

Boiling Point
DegreeReference
87.5 °C peer reviewed
Volatilization
1,2-Dimethylhydrazine is a weak base with a pKa of 7.87(1). This value indicates that methylhydrazine will partially exist as a cation in water and moist soil surfaces and cations do not volatilize. The Henry's Law constant for the free base of methylhydrazine is estimated as 3X10-6 atm-cu m/mole(SRC) from its vapor pressure, 50 mm Hg(2), and water solubility, 1X10+6 mg/L(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)(4) is estimated as 5 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)(4) is estimated as 62 days(SRC). Methylhydrazine's Henry's Law constant indicates that the free base may volatilize from moist soil surfaces(SRC). The potential for volatilization of methylhydrazine from dry soil surfaces may exist(SRC) based on its vapor pressure(2).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc for methylhydrazine can be estimated to be 18(SRC). According to a classification scheme(2), this estimated Koc value suggests that methylhydrazine is expected to have very high mobility in soil. The pKa of methylhydrazine is 7.87(3). This pKa value indicates that this compound will partially exist as a cation in moist soils and cations generally adsorb more strongly to organic carbon and clay than the corresponding free base(4).
Vapor Pressure
PressureReference
43.8

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus FlavusKate et al. 2023
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Flavusinoculated potato samplesGC-MSno
Pectobacterium Carotovoruminoculated potato samplesGC-MSno


2,6-dimethylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2,6-DIMETHYLPYRAZINE
108-50-9
Pyrazine, 2,6-dimethyl-
3,5-Dimethylpyrazine
2,6-Dimethylpiazine
2,6-Dimethylparadiazine
2,6-Dimethyl-1,4-diazine
FEMA No. 3273
N77Q72C9I3
2,6DMP
CCRIS 2930
2,6-Dimethylpyrazine (natural)
2,6-dimethyl pyrazine
EINECS 203-589-4
UNII-N77Q72C9I3
2,6 dimethylpyrazine
2,6-dimethyl-pyrazine
2,6-Dimethylpyrazine, 98%
SCHEMBL110425
2,6-dioxaspiro[3,3]heptane
2,6-Dimethylpyrazine,typically
SCHEMBL7120213
DTXSID5047619
PYRAZINE, 2,6-DIMETHYL
CHEBI:89791
FEMA 3273
AMY23200
2,6-DIMETHYLPYRAZINE [FCC]
2,6-DIMETHYLPYRAZINE [FHFI]
MFCD00006148
2,6-Dimethylpyrazine, >=98%, FG
AKOS006220715
CS-W021530
HY-W040790
2,6-Dimethylpyrazine, analytical standard
AC-23626
AS-14441
PD158374
ALPHAPRODINEHYDROCHLORIDECII(250MG)
DB-003244
D1527
NS00012336
2,6-Dimethylpyrazine, natural (US), >=90%
EN300-105139
O10631
Q-100050
Q27161978
F0001-0172
InChI=1/C6H8N2/c1-5-3-7-4-6(2)8-5/h3-4H,1-2H
Microorganism:

Yes

IUPAC name2,6-dimethylpyrazine
SMILESCC1=CN=CC(=N1)C
InchiInChI=1S/C6H8N2/c1-5-3-7-4-6(2)8-5/h3-4H,1-2H3
FormulaC6H8N2
PubChem ID7938
Molweight108.14
LogP0.5
Atoms8
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds pyrazines heterocyclic compounds
CHEBI-ID89791
Supernatural-IDSN0127170

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEnterobacter CloacaeNALawal et al. 2018
ProkaryotaPseudochrobactrum SaccharolyticumNematicidal activitycow dungXU et al. 2015
ProkaryotaWautersiella FalseniiNematicidal activitycow dungXU et al. 2015
ProkaryotaAchromobacter XylosoxidansNematicidal activitycow dungXU et al. 2015
ProkaryotaAlcaligenes FaecalisnanaSu et al. 2016
ProkaryotaBrevibacterium EpidermidisnanaSu et al. 2016
ProkaryotaProteus VulgarisnanaSu et al. 2016
ProkaryotaProvidencia RettgerinanaSu et al. 2016
ProkaryotaPseudochrobactrum AsaccharolyticumnanaSu et al. 2016
Lentinula EdodesGeng et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEnterobacter CloacaeLevine EMB agar (LEA) (Fluka Analytical, UK)GC-MSno
ProkaryotaPseudochrobactrum SaccharolyticumLB liquidSPME-GC/MSno
ProkaryotaWautersiella FalseniiLB liquidSPME-GC/MSno
ProkaryotaAchromobacter XylosoxidansLB liquidSPME-GC/MSno
ProkaryotaAlcaligenes FaecalisLB mediumSPME-GC/MSno
ProkaryotaBrevibacterium EpidermidisLB mediumSPME-GC/MSno
ProkaryotaProteus VulgarisLB mediumSPME-GC/MSno
ProkaryotaProvidencia RettgeriLB mediumSPME-GC/MSno
ProkaryotaPseudochrobactrum AsaccharolyticumLB mediumSPME-GC/MSno
Lentinula EdodesJiuqu (traditional wheat Qu)GC-IMSno


2-methylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2-METHYLPYRAZINE
109-08-0
Methylpyrazine
Pyrazine, methyl-
Pyrazine, 2-methyl-
2-METHYL PYRAZINE
2-Methyl-1,4-diazine
2-methyl-pyrazine
FEMA No. 3309
methyl-pyrazine
MFCD00006142
RVC6500U9C
DTXSID4047620
CHEBI:89015
NSC-30412
NSC-49138
pyrazine, 2-methyl
WLN: T6N DNJ B1
CCRIS 2927
EINECS 203-645-8
NSC 30412
UNII-RVC6500U9C
methyl pyrazine
AI3-36550
5-methylpyrazine
monomethylpyrazine
5-methyl pyrazine
NSC30412
2-Methyl-1,4-diazinen
2-Methylpyrazine, >=99%
CHEMBL479791
2-METHYLPYRAZINE [FCC]
2-METHYLPYRAZINE [FHFI]
DTXCID2027620
FEMA 3309
AMY23232
NSC49138
Tox21_303776
AKOS009156584
AC-3331
HY-W067358
MCULE-8697656728
2-Methylpyrazine, >=99%, FCC, FG
NCGC00188126-01
NCGC00357068-01
10-98-0
AS-13593
CAS-109-08-0
PD158410
DB-002464
CS-0059136
M0736
NS00020926
EN300-40909
D73175
Q-100051
Q27161158
F8889-9211
Z415628164
InChI=1/C5H6N2/c1-5-4-6-2-3-7-5/h2-4H,1H
2-Methylpyrazine, European Pharmacopoeia (EP) Reference Standard
2-Methylpyrazine, Pharmaceutical Secondary Standard; Certified Reference Material
Microorganism:

Yes

IUPAC name2-methylpyrazine
SMILESCC1=NC=CN=C1
InchiInChI=1S/C5H6N2/c1-5-4-6-2-3-7-5/h2-4H,1H3
FormulaC5H6N2
PubChem ID7976
Molweight94.11
LogP0.2
Atoms7
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationheterocyclic compounds nitrogen compounds pyrazines aromatic compounds
CHEBI-ID89015
Supernatural-IDSN0040749

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANAHewett et al. 2020
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
EukaryotaAspergillus FumigatusNANAAhmed et al. 2018
ProkaryotaEscherichia ColiNANAJünger et al. 2012
ProkaryotaPseudomonas Putidainhibitory activity against oomycete and fungal pathogens, antibacterial activity against R. pseudosolanacearum, dimethyl trisulphide nematicidal activity against R. similis, effect against Phytophthora rot on black pepper shoot cuttingsBlack pepper rootAgisha et al. 2019
ProkaryotaKlebsiella Pneumoniaeclinical isolate,bacteremic patientsRees et al. 2017
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 SubtilisZhang et al. 2021
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
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
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
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaStaphylococcus EpidermidisAmerican Type Culture CollectionJenkins and Bean 2020
EukaryotaGoffeauzyma Gilvescensinhibitory and promoting effects on the growth of different microorganismsisolate from Saxifraga cespitosa, Ny-Ålesund (Svalbard Archipelago, Arctic); CCTCC (China Center for Type Culture Collection, Wuhan, Hubei, China)Niu et al. 2022
EukaryotaRhodotorula Mucilaginosainhibitory and promoting effects on the growth of different microorganismsisolate from Dryas octopetala, Ny-Ålesund (Svalbard Archipelago, Arctic); CCTCC (China Center for Type Culture Collection, Wuhan, Hubei, China)Niu et al. 2022
EukaryotaVishniacozyma Victoriaeinhibitory and promoting effects on the growth of different microorganismsisolate from Dryas octopetala, Ny-Ålesund (Svalbard Archipelago, Arctic); CCTCC (China Center for Type Culture Collection, Wuhan, Hubei, China)Niu et al. 2022
ProkaryotaPseudomonas Fluorescensn/aNAFernando et al. 2005
ProkaryotaPseudomonas Corrugatan/aNAFernando et al. 2005
ProkaryotaPseudomonas Chlororaphisn/aNAFernando et al. 2005
ProkaryotaPseudomonas Aurantiacan/aNAFernando et al. 2005
ProkaryotaBacillus Sp.n/aNAZou et al. 2007
ProkaryotaStenotrophomonas Maltophilian/aNAZou et al. 2007
ProkaryotaAlcaligenes Faecalisn/aNAZou et al. 2007
ProkaryotaArthrobacter Nitroguajacolicusn/aNAZou et al. 2007
ProkaryotaLysobacter Gummosusn/aNAZou et al. 2007
ProkaryotaSporosarcina Ginsengisolin/aNAZou et al. 2007
EukaryotaPleurotus CystidiosusnanaUsami et al. 2014
ProkaryotaStreptomyces Sp.n/aNADickschat et al. 2005_2
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/aNADickschat et al. 2005_3
ProkaryotaStenotrophomonas MaltophiliaclinicPreti et al. 2009
ProkaryotaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
ProkaryotaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
EukaryotaFusarium Sp.NADickschat 2017
EukaryotaAspergillus Sp.NADickschat 2017
ProkaryotaPseudomonas Putidanablack pepper rootSheoran et al. 2015
ProkaryotaPseudomonas Putidapositive influence of the plant root growth and protection against soil-borne pathogensNASheoran et al. 2015
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaPsychrobacillus VulpisNANAToral et al. 2021
ProkaryotaPseudomonas PutidaNANAPatel et al. 2020
ProkaryotaBacillus SubtilisNANALee et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBSPME/GC-MSno
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno
EukaryotaAspergillus FumigatusAMMTD/GC-MSno
ProkaryotaEscherichia ColiColumbia sheep bloodTD/GC-MS and MCC-IMSno
ProkaryotaPseudomonas PutidaLuria Bertani Agarhead space GC/MSno
ProkaryotaKlebsiella PneumoniaeBHI, LB, MHB, TSBSPME / GCxGC-TOFMSno
ProkaryotaBacillus SubtilisLB agarGC-MSno
ProkaryotaPseudomonas FluorescensLB agarGC-MSno
ProkaryotaBacillus SubtilisLB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas Sp.LB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTSB mediaHS-SPME/GC-MSno
ProkaryotaEscherichia ColiTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus EpidermidisTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusBHI media, LB media, MHB media, TSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaStaphylococcus EpidermidisBHI media, LB media, TSB mediaHS-SPME/GC×GC-TOFMSno
EukaryotaGoffeauzyma Gilvescensartificial nectar mediaGC-MSno
EukaryotaRhodotorula Mucilaginosaartificial nectar mediaGC-MSno
EukaryotaVishniacozyma Victoriaeartificial nectar mediaGC-MSno
ProkaryotaPseudomonas Fluorescensn/an/ano
ProkaryotaPseudomonas Corrugatan/an/ano
ProkaryotaPseudomonas Chlororaphisn/an/ano
ProkaryotaPseudomonas Aurantiacan/an/ano
ProkaryotaBacillus Sp.n/an/ano
ProkaryotaStenotrophomonas Maltophilian/an/ano
ProkaryotaAlcaligenes Faecalisn/an/ano
ProkaryotaArthrobacter Nitroguajacolicusn/an/ano
ProkaryotaLysobacter Gummosusn/an/ano
ProkaryotaSporosarcina Ginsengisolin/an/ano
EukaryotaPleurotus CystidiosusnaGC/MS, GC-O, AEDAno
ProkaryotaStreptomyces Sp.n/an/ano
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/an/ano
ProkaryotaStenotrophomonas MaltophiliaBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
ProkaryotaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
EukaryotaFusarium Sp.no
EukaryotaAspergillus Sp.no
ProkaryotaPseudomonas PutidaLuria Bertani AgarHeadspace GC/MSno
ProkaryotaPseudomonas PutidaTSBPropak Q adsorbent trap/GC-MSno
ProkaryotaStaphylococcus EquorumMOLPHS-SPME-GC/MSno
ProkaryotaStaphylococcus Equorumtryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas SegetisMOLPHS-SPME-GC/MSno
ProkaryotaPseudomonas Segetistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisMOLPHS-SPME-GC/MSno
ProkaryotaPsychrobacillus Vulpistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas PutidaLuria–Bertani agar (LBA)GC-MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno


5-phenyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione

Compound Details

Synonymous names
Phenallymal
Alphenal
Alpheba
Phenallymalum
Allofenyl
Alphenate
Fenallymal
Prophenal
Allophenylum
115-43-5
Alphasem
Tubergal
5-Allyl-5-phenylbarbituric acid
5-Phenyl-5-allylbarbituric acid
BARBITURIC ACID, 5-ALLYL-5-PHENYL-
Acido 5-fenil-5-allilbarbiturico
5-phenyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
7T7L08Q9JI
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-phenyl-5-(2-propenyl)-
5-Phenyl-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Dorlotin
Luxomnin
Alphenal (1mg/ml in Acetonitrile)
5-Allyl-5-phenylbarbitursaeure
EINECS 204-089-9
BRN 0227510
UNII-7T7L08Q9JI
Acido 5-fenil-5-allilbarbiturico [Italian]
PHENALLYMAL [MI]
5-24-09-00334 (Beilstein Handbook Reference)
SCHEMBL715099
5-allyl-5-phenylpyrimidine-2,4,6(1h,3h,5h)-trione
DTXSID60150919
CHEBI:134993
STK299181
AKOS003382444
5-ALLYL-5-PHENYL-BARBITURIC ACID
NS00023739
Q414954
SR-01000883751
SR-01000883751-1
5-Allyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione #
5-phenyl-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Microorganism:

No

IUPAC name5-phenyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
SMILESC=CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2
InchiInChI=1S/C13H12N2O3/c1-2-8-13(9-6-4-3-5-7-9)10(16)14-12(18)15-11(13)17/h2-7H,1,8H2,(H2,14,15,16,17,18)
FormulaC13H12N2O3
PubChem ID8274
Molweight244.25
LogP1.7
Atoms18
Bonds3
H-bond Acceptor3
H-bond Donor2
Chemical Classificationnitrogen compounds heterocyclic compounds carbamides benzenoids azines aromatic compounds
CHEBI-ID134993
Supernatural-IDSN0415631

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus FlavusKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Flavusinoculated potato samplesGC-MSno


2-cyanoacetohydrazide

Compound Details

Synonymous names
Cyanoacetohydrazide
2-Cyanoacetohydrazide
140-87-4
Cyacetacide
Cyacetazide
Cyanoacetic acid hydrazide
Cyanoacethydrazide
Cyacetacid
Cyacetazid
Mackreazid
Neohydrazid
Armazal
Cianazil
Cyanazide
Cyanizide
Cyazide
Dictycide
Dictyzide
Hidacian
Hidaciann
Leandin
Reazide
Tsiazid
Cyazid
Helmox
Reacid
Reazid
Cyanoethydrazide
Cyanacethydrazide
Cyanacetohydrazide
Cyanacetylhydrazide
Cyanoacetylhydrazide
Malonitrile hydrazide
ACETIC ACID, CYANO-, HYDRAZIDE
(Cyanoacetyl)hydrazine
Usaf kf-18
Malononitrile hydrazide
Cyanoacetyl hydrazide
Kyanacethydrazid
Cyanacetic acid hydrazide
AB-42
Cyanoacetic hydrazide
Cyanoacetylhydrazine
NSC-24261
Cyanacetic acid, hydrazide
.alpha.-Cyanoacetohydrazide
DTXSID9046572
40H59YCS67
NCGC00166240-01
Cyanacethydrazine
Cyacetacide [INN]
Cyazide (VAN)
DTXCID7026572
Ciacetacida
Cyacetacidum
Kyanacethydrazid [Czech]
USAF kf-28
Cyacetacidum [INN-Latin]
methane, C-cyano-C-hydrazinocarbonyl-
Ciacetacida [INN-Spanish]
CAS-140-87-4
HSDB 2701
Cyacetacide [INN:BAN]
EINECS 205-437-2
NSC 24261
BRN 1751498
UNII-40H59YCS67
AI3-23466
2-Cyanoacethydrazide
2-Cyanoacetylhydrazide
CYACETACIDE [MI]
cyanoacetic acid hydrazone
acetohydrazide, 2-cyano-
WLN: ZMV1CN
Cyanoacetohydrazide, 98%
CYACETACIDE [HSDB]
Cyanoacetic acid, hydrazide
CYACETACIDE [MART.]
4-02-00-01895 (Beilstein Handbook Reference)
(.alpha.-Cyanoacetyl)hydrazine
CHEMBL2106008
Alpha-cyanoacetic acid, hydrazide
AMY5330
Acetic acid, 2-cyano-, hydrazide
HY-B0994
NSC24261
Tox21_112366
BBL010619
MFCD00007611
STK298870
AKOS000119759
Tox21_112366_1
CCG-213834
CS-4488
NCGC00166240-02
DB-042536
NS00024567
EN300-19656
AB00442940_02
12B-129
AC-907/25014397
SR-01000944252
J-007426
J-520129
SR-01000944252-1
BRD-K39371216-001-01-3
Q27258330
F2111-0015
Z104474618
InChI=1/C3H5N3O/c4-2-1-3(7)6-5/h1,5H2,(H,6,7
Microorganism:

Yes

IUPAC name2-cyanoacetohydrazide
SMILESC(C#N)C(=O)NN
InchiInChI=1S/C3H5N3O/c4-2-1-3(7)6-5/h1,5H2,(H,6,7)
FormulaC3H5N3O
PubChem ID8820
Molweight99.09
LogP-1.3
Atoms7
Bonds1
H-bond Acceptor3
H-bond Donor2
Chemical Classificationnitrogen compounds nitriles hydrazines

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus NigerKate et al. 2023
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Nigerinoculated potato samplesGC-MSno
Pectobacterium Carotovoruminoculated potato samplesGC-MSno


Pyrimidine

Compound Details

Synonymous names
PYRIMIDINE
289-95-2
1,3-Diazine
Metadiazine
m-Diazine
1,3-Diazabenzene
Miazine
Pyrimidine base
pyrimidin
1,3-Diazin
CHEBI:16898
UNII-K8CXK5Q32L
EINECS 206-026-0
K8CXK5Q32L
NSC 89305
NSC-89305
25247-63-6
DTXSID1051228
EC 206-026-0
pyrimidine phase I
NSC89305
pyrimidine phase II
pyrimidine phase IV
MFCD00006059
Pyrimidine dimer
Pyrimidine, dimer
PYRIMIDINE [MI]
Epitope ID:140100
Pyrimidine, >=98.0%
CHEMBL15562
AMY390
DTXCID4029850
HY-Y0519
AKOS015892547
SY021098
CS-0015301
NS00009251
P0662
EN300-80760
C00396
H10864
A819713
Q207722
W-202211
InChI=1/C4H4N2/c1-2-5-4-6-3-1/h1-4
Z2768165052
P1R
Microorganism:

Yes

IUPAC namepyrimidine
SMILESC1=CN=CN=C1
InchiInChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H
FormulaC4H4N2
PubChem ID9260
Molweight80.09
LogP-0.4
Atoms6
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds azines nitrogen compounds heterocyclic compounds
CHEBI-ID16898
Supernatural-IDSN0059910

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStaphylococcus AureusNANAZhu et al. 2010
ProkaryotaStreptococcus PneumoniaeNANAKaeslin et al. 2021
ProkaryotaIgnatzschineria Indicapig (Sus scrofa domesticus) carcassCernosek et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStaphylococcus AureusTSBSESI-MSno
ProkaryotaStreptococcus PneumoniaeBHISESI-MSno
ProkaryotaIgnatzschineria IndicaNutrient AgarSPME-GC-MSno


Pyrazine

Mass-Spectra

Compound Details

Synonymous names
PYRAZINE
290-37-9
1,4-Diazine
p-Diazine
Paradiazine
Piazine
1,4-Diazabenzene
pyrazin
1,4-Diazin
NSC-400221
DTXSID8049410
FEMA NO. 4015
CHEBI:30953
pyrazine phase IV
pyrazine phase III
MFCD00006122
2JKE371789
Pyrazines
CCRIS 1331
EINECS 206-027-6
NSC 400221
UNII-2JKE371789
Piazine (obsol.)
1, 4-Diazabenzene
Pyrazine, >=99%
PYRAZINE [FHFI]
PYRAZINE [MI]
Pyrazine, >=99%, FG
Pyrazine, analytical standard
CHEMBL15797
DTXCID7029370
AMY2647
STR04325
Tox21_202911
BBL027560
NSC400221
STL373491
AKOS006223200
Pyrazine, purum, >=98.0% (GC)
CS-W013756
MCULE-7343822850
NCGC00260457-01
BP-10420
CAS-290-37-9
DB-003769
NS00010841
P0544
EN300-72616
A819731
A935224
Q424284
Q-100368
InChI=1/C4H4N2/c1-2-6-4-3-5-1/h1-4
F0001-0907
Microorganism:

Yes

IUPAC namepyrazine
SMILESC1=CN=CC=N1
InchiInChI=1S/C4H4N2/c1-2-6-4-3-5-1/h1-4H
FormulaC4H4N2
PubChem ID9261
Molweight80.09
LogP-0.2
Atoms6
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds pyrazines heterocyclic compounds
CHEBI-ID30953
Supernatural-IDSN0198952

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAAhmed et al. 2018
EukaryotaAspergillus Versicolorwild strainsSchleibinger et al. 2005
EukaryotaChaetomium Globosumwild strainsSchleibinger et al. 2005
EukaryotaEurotium Amstelodamiwild strainsSchleibinger et al. 2005
EukaryotaPenicillium Brevicompactumwild strainsSchleibinger et al. 2005
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
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 110NACalvo et al. 2020
ProkaryotaPseudomonas Fluorescensn/aNAFernando et al. 2005
ProkaryotaPseudomonas Corrugatan/aNAFernando et al. 2005
ProkaryotaPseudomonas Chlororaphisn/aNAFernando et al. 2005
ProkaryotaPseudomonas Aurantiacan/aNAFernando et al. 2005
EukaryotaSaccharomyces Cerevisiaen/aNABruce et al. 2004
ProkaryotaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
ProkaryotaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaPsychrobacillus VulpisNANAToral et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusAMMTD/GC-MSno
EukaryotaAspergillus Versicoloringrain (woodchip)SIM/GCMS / Tenaxno
EukaryotaChaetomium Globosumingrain (woodchip)SIM/GCMS / Tenaxno
EukaryotaEurotium Amstelodamiingrain (woodchip)SIM/GCMS / Tenaxno
EukaryotaPenicillium Brevicompactumingrain (woodchip)SIM/GCMS / Tenaxno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTSB mediaHS-SPME/GC-MSno
ProkaryotaBacillus VelezensisMOLP mediaSPME/GC-MSno
ProkaryotaPseudomonas Fluorescensn/an/ano
ProkaryotaPseudomonas Corrugatan/an/ano
ProkaryotaPseudomonas Chlororaphisn/an/ano
ProkaryotaPseudomonas Aurantiacan/an/ano
EukaryotaSaccharomyces Cerevisiaen/an/ano
ProkaryotaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
ProkaryotaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
ProkaryotaStaphylococcus EquorumMOLPHS-SPME-GC/MSno
ProkaryotaStaphylococcus Equorumtryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas SegetisMOLPHS-SPME-GC/MSno
ProkaryotaPseudomonas Segetistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisMOLPHS-SPME-GC/MSno
ProkaryotaPsychrobacillus Vulpistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno


1,2,4,5-tetrazine

Compound Details

Synonymous names
1,2,4,5-TETRAZINE
290-96-0
s-Tetrazine
sym-Tetrazine
1,2,4,5-Tetraazine
s-Tetrazine (8CI)
1,2,4,5-Tetraazine #
CHEBI:39320
DTXSID90183194
CS-M0126
MFCD01682602
SY013765
DB-225860
F52551
A936718
InChI=1/C2H2N4/c1-3-5-2-6-4-1/h1-2
Q27119812
Microorganism:

Yes

IUPAC name1,2,4,5-tetrazine
SMILESC1=NN=CN=N1
InchiInChI=1S/C2H2N4/c1-3-5-2-6-4-1/h1-2H
FormulaC2H2N4
PubChem ID9263
Molweight82.06
LogP-1.4
Atoms6
Bonds0
H-bond Acceptor4
H-bond Donor0
Chemical Classificationnitrogen compounds heterocyclic compounds azines
CHEBI-ID39320

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus NigerKate et al. 2023
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Nigerinoculated potato samplesGC-MSno
Pectobacterium Carotovoruminoculated potato samplesGC-MSno


Hydrazine

Compound Details

Synonymous names
HYDRAZINE
302-01-2
Diamine
Levoxine
Hydrazine base
Oxytreat 35
Diazane
Hydrazin
Hydrazyna
Hydrazine, anhydrous
Nitrogen hydride
Hydrazines
Hydrazine (anhydrous)
Hydrazyna [Polish]
RCRA waste number U133
Hydrazine anhydrous
CCRIS 335
Amerzine
HSDB 544
N2H4
H2NNH2
UNII-27RFH0GB4R
EINECS 206-114-9
27RFH0GB4R
CHEBI:15571
119775-10-9
DTXSID3020702
H 70 (FUEL)
NITROGEN HYDRIDE (N2H4)
HYDRAZINE (IARC)
HYDRAZINE [IARC]
HDZ
ISONIAZID IMPURITY E (EP IMPURITY)
ISONIAZID IMPURITY E [EP IMPURITY]
ALLOPURINOL IMPURITY F (EP IMPURITY)
ALLOPURINOL IMPURITY F [EP IMPURITY]
UN2029
UN3293
Hydrazine/Hydrazine sulfate
RCRA waste no. U133
Hydrazine Standard: N2H4 @ 100 mg/L in 1% Acetic Acid
Hydrazine Standard: N2H4 @ 1000 mg/L in 1% Acetic Acid
Diamidogen
Hidrazine
amino nitrogen
Zerox
Hydrazine fume
(anhydrous)
Catalyzed hydrazine
Scav-Ox II
HYDRAZINE (HYDRAZINE SULFATE)
Zerox (Salt/Mix)
Amerzine (Salt/Mix)
Diamine, hydrazine base
HYDRAZINE [MI]
HYDRAZINE [HSDB]
NH2NH2
Scav-Ox II (Salt/Mix)
HYDRAZINE [WHO-DD]
Hydrazine, anhydrous, 98%
Nitrogen hydride, (N2H4)
NH2-NH2
UN 2029 (Salt/Mix)
UN 2030 (Salt/Mix)
DTXCID30702
Hydrazine (hydrazine sulphate)
HYDRAZINE, (ANHYDROUS)
Catalyzed hydrazine (Salt/Mix)
CHEMBL1237174
HYDRAZINE AQUEOUS SOLUTION
DTXSID70159610
CREXVNNSNOKDHW-UHFFFAOYSA-N
MFCD00011417
STL281862
AKOS000269060
NCGC00188947-01
BP-13613
DB-007559
H0172
H0204
H0697
NS00014234
C05361
Q58447
J-017830
Q27110398
HZN
Microorganism:

No

IUPAC namehydrazine
SMILESNN
InchiInChI=1S/H4N2/c1-2/h1-2H2
FormulaH4N2
PubChem ID9321
Molweight32.046
LogP-1.5
Atoms2
Bonds0
H-bond Acceptor2
H-bond Donor2
Chemical Classificationnitrogen compounds hydrazines
CHEBI-ID15571
Supernatural-IDSN0260111

mVOC Specific Details

Boiling Point
DegreeReference
113.55 °C peer reviewed
Volatilization
A pKa of 7.96(1) indicates hydrazine will exist partially in the cation or 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). The Henry's Law constant for the neutral species of hydrazine is estimated as 6.07X10-7 atm-cu m/mole(SRC) derived from its vapor pressure, 14.4 mm Hg(2), and assigned value for water solubility of 1.0X10+6 mg/L (miscible)(3). This Henry's Law constant indicates that hydrazine is expected to be essentially nonvolatile from water and moist soil surfaces(4). With an air velocity at the liquid surface of 63.5 cm/sec, the volatilization of hydrazine from petri dishes containing 25%, 50% and 75% hydrazine-water mixtures was 0.5 g after 6.66 hr, about 1 g after 5 hr, and about 3 g after 5 hr, respectively(5). At each concentration, the rate of volatilization decreased with time(5). Hydrazine's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of hydrazine from dry soil surfaces may exist(SRC) based upon its vapor pressure(1).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of hydrazine can be estimated to be 13(SRC). According to a classification scheme(2), this estimated Koc value suggests that hydrazine is expected to have very high mobility in soil. The pKa of hydrazine is 7.92(3), indicating that this compound will exist partially in the cation form in the environment and cations generally adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(4). The nature and extent of hydrazine adsorption by clays and soils is very dependent on suspension pH and on the types of surface functional groups present on the solid matrix. Under acidic conditions, pH 4.0, 99.9% of the hydrazine is present as the protonated species and should be able to readily replace Na+ from exchange sites(3). Under alkaline conditions, pH 8.0, approximately 50% of the hydrazine is protonated and 50% is in neutral form. The primary mechanism of hydrazine adsorption in a montmorillonite clay suspension was cation exchange, both at pH 4 and 8; adsorption of hydrazine was lower at the higher pH value(3). The main mechanism for hydrazine retention at pH 4 and at low hydrazine concentrations in the upper Arrendondo soil horizon (fine sand) was also cation exchange. At higher concentrations more than 60% of the hydrazine interacted with a different type of binding site, possibly with organic-surface functional groups such as carbonyl groups(3). Under alkaline conditions, using upper horizon Arrendondo soil, (at pH 8.0) hydrazine was adsorbed more readily than at pH 4(3).
Vapor Pressure
PressureReference
12.2

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus FlavusKate et al. 2023
Aspergillus NigerKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Flavusinoculated potato samplesGC-MSno
Aspergillus Nigerinoculated potato samplesGC-MSno


Acetohydrazide

Compound Details

Synonymous names
Acethydrazide
Acetohydrazide
1068-57-1
Acetylhydrazine
Acetic hydrazide
Acetic acid hydrazide
Monoacetylhydrazine
Acetyl hydrazide
N-Acetylhydrazine
Monoacetyl hydrazine
Ethanehydrazonic acid
ACETIC ACID, HYDRAZIDE
Hydrazine, acetyl-
Acetyl hydrazine
acetohydrazine
ENT-61241
NSC 53155
Hydrazid kyseliny octove
NSC 2271
MFCD00007610
CHEBI:2422
SK0DPC9098
NSC-2271
NSC-53155
WLN: ZMV1
acethydrazine
CCRIS 4791
Hydrazid kyseliny octove [Czech]
EINECS 213-948-7
UNII-SK0DPC9098
AI3-61241
ethanoic hydrazide
AcN2 deriv
acetohydrazonic acid
acetic acid hydrazone
Acethydrazide, 90%
ethanoic acid hydrazide
methane, hydrazinocarbonyl-
CHEMBL3091859
DTXSID9020900
CHEBI:48978
OFLXLNCGODUUOT-UHFFFAOYSA-
NSC2271
Ald3-H_000034
CS-D1403
NSC53155
Ald3.1-H_000314
Ald3.1-H_000633
Ald3.1-H_000952
AB6005
BBL018600
STL194154
AKOS000104423
AB00888
GS-3116
BP-30010
Acetyl Hydrazine Contains~10% acetic acid
DB-029410
A0789
Acethydrazide (moist with methylene chloride)
AM20080014
NS00021483
EN300-18497
C07447
A801521
J-519529
Q4678005
Z58981787
InChI=1/C2H6N2O/c1-2(5)4-3/h3H2,1H3,(H,4,5)
Microorganism:

No

IUPAC nameacetohydrazide
SMILESCC(=O)NN
InchiInChI=1S/C2H6N2O/c1-2(5)4-3/h3H2,1H3,(H,4,5)
FormulaC2H6N2O
PubChem ID14039
Molweight74.08
LogP-1.6
Atoms5
Bonds0
H-bond Acceptor2
H-bond Donor2
Chemical Classificationnitrogen compounds hydrazines
CHEBI-ID2422
Supernatural-IDSN0264016

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus FlavusKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Flavusinoculated potato samplesGC-MSno


2,3,5,6-tetramethylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2,3,5,6-Tetramethylpyrazine
TETRAMETHYLPYRAZINE
1124-11-4
Ligustrazine
Pyrazine, tetramethyl-
Bs factor
Tetrapyrazine
Tetramethylpyrazin
Chuanxiongzine
Liqustrazine
Ligustizine
2,3,5,6-Tetramethyl pyrazine
chuanxingzine
FEMA No. 3237
2,3,5,6,-Tetramethyl-1,4-pyrazine
MFCD00006146
V80F4IA5XG
MLS000069594
DTXSID6047070
FEMA 3237
Pyrazine, 2,3,5,6-tetramethyl-
NSC-36080
NSC-46451
SMR000059042
2,5,6-Tetramethylpyrazine
TMPZ
EINECS 214-391-2
NSC 36080
NSC 46451
UNII-V80F4IA5XG
2,3,5,6-Tetramethylpyrazine (natural)
Ligustrazin
CHUANXIONGQIN
Opera_ID_849
TMP?
SCHEMBL77624
LIGUSTRAZINE [WHO-DD]
CHEMBL303697
2,3,5,6-Tetramethyl-pyrazine
DTXCID4027070
FINHMKGKINIASC-UHFFFAOYSA-
CHEBI:133246
Pyrazine, 2,3,5,6-tetramethyl
HMS2235K03
HMS3371J08
HY-N0264
NSC36080
NSC46451
Tox21_302313
BBL012277
s3956
STL163591
2,3,5,6-Tetramethylpyrazine, 98%
AKOS003398567
CCG-207974
CS-W023183
MCULE-2834033564
NCGC00247063-01
NCGC00256097-01
AC-10515
AC-34076
AS-13206
SY011353
CAS-1124-11-4
DB-003786
2,3,5,6-TETRAMETHYLPYRAZINE [FCC]
AM20070299
NS00013238
T0972
2,3,5,6-TETRAMETHYLPYRAZINE [FHFI]
2,3,5,6-Tetramethylpyrazine, >=98%, FG
EN300-113945
F11202
2,3,5,6-Tetramethylpyrazine, analytical standard
A802574
AC-907/25014219
Q-100069
2,3,5,6-Tetramethylpyrazine, natural, >=98%, FG
Q11319317
Z1741976694
2,3,5,6-Tetramethylpyrazine, Vetec(TM) reagent grade, 98%
InChI=1/C8H12N2/c1-5-6(2)10-8(4)7(3)9-5/h1-4H3
Microorganism:

Yes

IUPAC name2,3,5,6-tetramethylpyrazine
SMILESCC1=C(N=C(C(=N1)C)C)C
InchiInChI=1S/C8H12N2/c1-5-6(2)10-8(4)7(3)9-5/h1-4H3
FormulaC8H12N2
PubChem ID14296
Molweight136.19
LogP1.3
Atoms10
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds pyrazines heterocyclic compounds
CHEBI-ID133246
Supernatural-IDSN0086678

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
ProkaryotaBacillus SubtilissoilChen et al. 2008
ProkaryotaCoraliitalea Coraliiisolate from the algal Chromera velia CCAP 1602/1Koteska et al. 2023
ProkaryotaBacillus Sp.n/aNASchulz and Dickschat 2007
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/aNASchulz and Dickschat 2007
ProkaryotaBacillus Subtilistriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al. 2004
ProkaryotaBacillus Amyloliquefacienstriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al. 2004
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/aNADickschat et al. 2005_3
ProkaryotaLoktanella Sp.n/aNADickschat et al. 2005_4
ProkaryotaDinoroseobacter Shibaen/aNADickschat et al. 2005_4
ProkaryotaSulfitobacter Pontiacusn/aNADickschat et al. 2005_6
ProkaryotaLoktanella Hongkongensisn/aNADickschat et al. 2005_6
ProkaryotaSulfitobacter Dubiusn/aNADickschat et al. 2005_6
ProkaryotaStappia Marinan/aNADickschat et al. 2005_6
ProkaryotaBurkholderia Ambifarian/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al. 2013
ProkaryotaPseudomonas Chlororaphisnarhizosphere of field-grown potato plantsHunziker et al. 2015
ProkaryotaPseudomonas Frederiksbergensisnaphyllosphere of field-grown potato plantsHunziker et al. 2015
ProkaryotaPseudomonas Syringaenaphyllosphere of field-grown potato plantsHunziker et al. 2015
ProkaryotaPseudomonas Jesseniinaphyllosphere of field-grown potato plantsHunziker et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
ProkaryotaBacillus SubtilisLuria-Bertani (LB)activated charcoral trapno
ProkaryotaCoraliitalea Coraliimarine broth agarOSSA/GC-MSno
ProkaryotaBacillus Sp.n/an/ano
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/an/ano
ProkaryotaBacillus SubtilisMurashige and Skoog mediumcapillary GC;GC/MSyes
ProkaryotaBacillus AmyloliquefaciensMurashige and Skoog mediumcapillary GC;GC/MSyes
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/an/ano
ProkaryotaLoktanella Sp.n/an/ano
ProkaryotaDinoroseobacter Shibaen/an/ano
ProkaryotaSulfitobacter Pontiacusn/an/ano
ProkaryotaLoktanella Hongkongensisn/an/ano
ProkaryotaSulfitobacter Dubiusn/an/ano
ProkaryotaStappia Marinan/an/ano
ProkaryotaBurkholderia AmbifariaLuria-Bertani medium, Malt Extractn/ano
ProkaryotaPseudomonas ChlororaphisLB mediumGC/MSyes
ProkaryotaPseudomonas FrederiksbergensisLB mediumGC/MSyes
ProkaryotaPseudomonas SyringaeLB mediumGC/MSyes
ProkaryotaPseudomonas JesseniiLB mediumGC/MSyes


2-methoxy-3-methylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2-METHOXY-3-METHYLPYRAZINE
2847-30-5
Pyrazine, 2-methoxy-3-methyl-
2-Methyl-3-methoxypyrazine
2-Methoxy-3-methyl-pyrazine
2-methoxy-3-methyl pyrazine
3-Methoxy-2-methylpyrazine
Pyrazine, 2-methoxy-3(or 5)-methyl-
Pyrazine, 2-methyl-3-methoxy
04O7CN9Q85
63378-13-2
chocolate pyrazine A
(Methoxy)methylpyrazine
UNII-04O7CN9Q85
2-Methoxy-3(or5)-methylpyrazine
EINECS 220-651-6
EINECS 269-881-9
SCHEMBL422296
CHEMBL329881
VKJIAEQRKBQLLA-UHFFFAOYSA-
DTXSID80863034
CHEBI:180378
2-Methoxy-3-methylpyrazine, 99%
MFCD00006127
AKOS015852303
METHOXY-3-METHYLPYRAZINE, 2-
CS-W016571
MCULE-1881794975
AC-16642
AM100621
AS-31022
DB-003285
M0810
NS00012836
EN300-157679
FEMA NO. 3183, 2-METHYL-3-METHOXY
2-Methoxy-3-methylpyrazine, >=99%, FCC, FG
FEMA NO. 3280, 2-METHYL-3-METHOXY-
A819467
A836123
Q-100359
W-104912
Q27247662
ETHYL2-METHYL-1,5-DIPHENYLPYRROLE-3-CARBOXYLATE
InChI=1/C6H8N2O/c1-5-6(9-2)8-4-3-7-5/h3-4H,1-2H3
2-METHOXY-3-METHYLPYRAZINE,70-90%,BALANCE10-30%2-METHOXY-6-METHYLPYRAZINE
Microorganism:

Yes

IUPAC name2-methoxy-3-methylpyrazine
SMILESCC1=NC=CN=C1OC
InchiInChI=1S/C6H8N2O/c1-5-6(9-2)8-4-3-7-5/h3-4H,1-2H3
FormulaC6H8N2O
PubChem ID17898
Molweight124.14
LogP1.2
Atoms9
Bonds1
H-bond Acceptor3
H-bond Donor0
Chemical Classificationaromatic compounds ethers heterocyclic compounds nitrogen compounds pyrazines
CHEBI-ID180378
Supernatural-IDSN0392647

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaLysobacter Capsiciantifungal activity against the growth of Pythium ultimum, Rhizoctonia solani and Sclerotinia minorNAVlassi et al. 2020
ProkaryotaChondromyces Crocatusn/aNADickschat et al. 2005_6
ProkaryotaChondromyces Crocatusn/asoil samples with decaying plant material collected on the island of Madeira, Portugal and near Iguaçu, BrazilSchulz et al. 2004
ProkaryotaChondromyces Crocatussoil samples with decaying plant material collected on the island of Madeira, Portugal and near Iguaçu, BrazilSchulz et al. 2004
ProkaryotaChondromyces Crocatusn/aNASchulz et al. 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaLysobacter CapsiciNA-mediaGC-MSno
ProkaryotaChondromyces Crocatusn/an/ano
ProkaryotaChondromyces Crocatusmalt extract CLSA headspace/ GC-msno


Furan-2-carbohydrazide

Compound Details

Synonymous names
furan-2-carbohydrazide
3326-71-4
2-Furoic acid hydrazide
2-Furoic hydrazide
2-Furohydrazide
Furoylhydrazide
2-Furoylhydrazine
2-Furancarbohydrazide
2-Furoylhydrazide
2-Furancarboxylic acid, hydrazide
Furoic acid, hydrazide
2-Furylcarbonylhydrazide
2-furancarboxylic acid hydrazide
2-Furancarbohydrazonic acid
2-FUROIC ACID, HYDRAZIDE
Pyromucic acid hydrazide
2-Furancarbonyl hydrazide
2-Furylcarboxylic acid hydrazide
MFCD00003235
Furan-2-carboxylic acid hydrazide
NSC 11957
NSC 35574
WLN: T5OJ BVMZ
NSC11957
NSC35574
Furancarboxylic acid, hydrazide
2-Furoicacidhydrazide
EINECS 222-046-2
BRN 0114435
AI3-62534
2-furanhydrazide
2-Furoichydrazide
2-furanoic hydrazide
furan 2-carbohydrazide
2-Furoic hydrazide, 98%
5-18-06-00125 (Beilstein Handbook Reference)
SCHEMBL140989
CHEMBL340492
DTXSID10186900
HMS1775C18
CS-M1764
NSC-11957
NSC-35574
STK121925
AKOS000194881
AM10044
MCULE-6130017029
AS-57679
SY048471
DB-048376
DB-293084
F1015
NS00029450
2-Furoic hydrazide, purum, >=97.0% (NT)
EN300-17784
F10405
A821702
AN-068/40170015
J-019120
J-521392
Z57036326
F3145-4915
InChI=1/C5H6N2O2/c6-7-5(8)4-2-1-3-9-4/h1-3H,6H2,(H,7,8
Microorganism:

Yes

IUPAC namefuran-2-carbohydrazide
SMILESC1=COC(=C1)C(=O)NN
InchiInChI=1S/C5H6N2O2/c6-7-5(8)4-2-1-3-9-4/h1-3H,6H2,(H,7,8)
FormulaC5H6N2O2
PubChem ID18731
Molweight126.11
LogP-0.5
Atoms9
Bonds1
H-bond Acceptor3
H-bond Donor2
Chemical Classificationhydrazines ethers furan derivatives heterocyclic compounds nitrogen compounds
Supernatural-IDSN0348234

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaMetschnikowia HawaiiensisNANALjunggren et al. 2019
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaMetschnikowia Hawaiiensisliquid YPD mediumGC-MSno


Ethyl N-aminocarbamate

Compound Details

Synonymous names
Ethyl carbazate
4114-31-2
Ethyl hydrazinecarboxylate
Hydrazinecarboxylic acid, ethyl ester
Carbethoxyhydrazine
Ethylcarbazate
Ethyl carbazinate
ethyl N-aminocarbamate
ethoxycarbohydrazide
Carboethoxyhydrazine
Monocarbethoxyhydrazine
N-(Carbethoxy)hydrazine
1-(Carbethoxy)hydrazine
(Ethoxycarbonyl)hydrazide
(Ethoxycarbonyl)hydrazine
Ethyl hydrazinocarboxylate
N-(Ethoxycarbonyl)hydrazine
1-(Ethoxycarbonyl)hydrazine
CARBAZIC ACID, ETHYL ESTER
1-Carbethoxy hydrazine
Ethoxycarbonyl hydrazide
Ethoxycarbonylhydrazine
NSC 2277
NSC 52663
ethylhydrazinecarboxylate
(Monocarbethoxy)hydrazine
MFCD00007595
Carbazic Acid Ethyl Ester
WLN: ZMVO2
EINECS 223-903-3
BRN 0878265
AI3-06208
ethyl hydrazinoformate
Ethoxy Formyl Hydrazine
Ethyl carbazate, 97%
ethylhydrazine carboxylate
ethyl hydrazine-carboxylate
hydrazinoformicacid ethylester
4-03-00-00174 (Beilstein Handbook Reference)
hydrazinoformic acid ethylester
SCHEMBL170635
hydrazinoformic acid ethyl ester
DTXSID1063308
VYSYZMNJHYOXGN-UHFFFAOYSA-
NSC2277
N-amino-carbamic acid ethyl ester
AMY23328
hydrazinecarboxylic acid ethyl ester
Hydrazinocarboxylic acid ethyl ester
NSC-2277
NSC52663
STR03390
BBL027647
NSC-52663
STL185589
AKOS000119588
CS-W008412
DB-049721
NS00021148
EN300-20511
D77690
A825450
W-106317
F0001-1162
Z104478458
InChI=1/C3H8N2O2/c1-2-7-3(6)5-4/h2,4H2,1H3,(H,5,6)
Microorganism:

No

IUPAC nameethyl N-aminocarbamate
SMILESCCOC(=O)NN
InchiInChI=1S/C3H8N2O2/c1-2-7-3(6)5-4/h2,4H2,1H3,(H,5,6)
FormulaC3H8N2O2
PubChem ID20064
Molweight104.11
LogP-0.4
Atoms7
Bonds2
H-bond Acceptor3
H-bond Donor2
Chemical Classificationnitrogen compounds hydrazines

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus NigerKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Nigerinoculated potato samplesGC-MSno


2,3-dimethylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2,3-DIMETHYLPYRAZINE
5910-89-4
Pyrazine, 2,3-dimethyl-
2,3-Dimethyl-1,4-diazine
2,3-Dimethyl-pyrazine
FEMA No. 3271
Dimethylpyrazine
25704-73-8
WHF7883D0V
Pyrazine, dimethyl-
CCRIS 2928
2,3-Dimethylpyrazine (natural)
2,3-dimethyl pyrazine
EINECS 227-630-0
UNII-WHF7883D0V
2,3-DIMETHLPYRAZINE
2,3-Dimethylpyrazine, 99%
CHEMBL96425
SCHEMBL151026
DTXSID4064058
SCHEMBL19919479
FEMA 3271
CHEBI:193606
2,3-DIMETHYLPYRAZINE [FCC]
2,3-DIMETHYLPYRAZINE [FHFI]
MFCD00006144
AKOS007930710
AM87085
CS-W016630
HY-W015914
MCULE-4503796486
s12348
AS-14037
2,3-Dimethylpyrazine, >=95%, FCC, FG
DB-003230
D1525
NS00020320
EN300-44307
A832162
2,3-Dimethylpyrazine, analytical reference material
Q27292638
Z448248230
InChI=1/C6H8N2/c1-5-6(2)8-4-3-7-5/h3-4H,1-2H
Microorganism:

Yes

IUPAC name2,3-dimethylpyrazine
SMILESCC1=NC=CN=C1C
InchiInChI=1S/C6H8N2/c1-5-6(2)8-4-3-7-5/h3-4H,1-2H3
FormulaC6H8N2
PubChem ID22201
Molweight108.14
LogP0.5
Atoms8
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationheterocyclic compounds nitrogen compounds pyrazines aromatic compounds
CHEBI-ID193606
Supernatural-IDSN0277951

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaSerratia Plymuthican/aNAWeise et al. 2014
ProkaryotaSerratia Proteamaculansn/aNAWeise et al. 2014
ProkaryotaSerratia Marcescensn/aNAWeise et al. 2014
ProkaryotaPseudomonas AeruginosaclinicPreti et al. 2009
ProkaryotaStenotrophomonas MaltophiliaclinicPreti et al. 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaSerratia PlymuthicaNBIIHeadspace trapping/ GC-MSno
ProkaryotaSerratia ProteamaculansNBIIHeadspace trapping/ GC-MSno
ProkaryotaSerratia MarcescensNBIIHeadspace trapping/ GC-MSno
ProkaryotaPseudomonas AeruginosaBlood agar/chocolate blood agaHS-SPME/GC-MS no
ProkaryotaStenotrophomonas MaltophiliaBlood agar/chocolate blood agaHS-SPME/GC-MS no


2-ethyl-5-methylpyrazine

Mass-Spectra

Compound Details

Synonymous names
2-ETHYL-5-METHYLPYRAZINE
13360-64-0
Pyrazine, 2-ethyl-5-methyl-
2-Methyl-5-ethylpyrazine
5-ethyl-2-methylpyrazine
2-Ethyl-5-methyl pyrazine
FEMA No. 3154
2,5-Methylethylpyrazine
2-Ethyl-5-methylpyrazine, 9CI, 8CI
Pyrazine, 5-ethyl-2-methyl
W41R8X574D
2-Ethyl-5-methylpyrazine(contains 2-Ethyl-6-methylpyrazine)
BRN 0956719
EINECS 236-416-6
UNII-W41R8X574D
AI3-34443
2-Ethyl-5-methyl-pyrazine
CHEMBL94558
SCHEMBL110053
DTXSID6065422
FEMA 3154
5-METHYL-2-ETHYLPYRAZINE
CHEBI:141542
EINECS 253-175-2
ETHYL-5-METHYLPYRAZINE, 2-
MFCD09039261
AKOS006272101
2-ETHYL-5-METHYLPYRAZINE [FHFI]
AS-50066
NS00021609
E78081
A806643
W-108295
Q27292273
98% pound mixture of 2-Ethyl-5-methylpyrazine and 2-ethyl-6-methylpyrazine pound(c)
Microorganism:

Yes

IUPAC name2-ethyl-5-methylpyrazine
SMILESCCC1=NC=C(N=C1)C
InchiInChI=1S/C7H10N2/c1-3-7-5-8-6(2)4-9-7/h4-5H,3H2,1-2H3
FormulaC7H10N2
PubChem ID25915
Molweight122.17
LogP1
Atoms9
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds heterocyclic compounds pyrazines nitrogen compounds
CHEBI-ID141542
Supernatural-IDSN0277536

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANADavis et al. 2020
ProkaryotaPseudomonas Putidainhibitory activity against oomycete and fungal pathogens, antibacterial activity against R. pseudosolanacearum, dimethyl trisulphide nematicidal activity against R. similis, effect against Phytophthora rot on black pepper shoot cuttingsBlack pepper rootAgisha et al. 2019
ProkaryotaBacillus SubtilisZhang et al. 2021
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
ProkaryotaSulfitobacter Pontiacusn/aNADickschat et al. 2005_6
ProkaryotaLoktanella Hongkongensisn/aNADickschat et al. 2005_6
ProkaryotaRoseobacter Gallaeciensisn/aNADickschat et al. 2005_6
ProkaryotaSulfitobacter Sp.n/aNADickschat et al. 2005_6
ProkaryotaStappia Marinan/aNADickschat et al. 2005_6
ProkaryotaDinoroseobacter Shibaen/aNADickschat et al. 2005_6
ProkaryotaOceanibulbus Indolifexn/aNADickschat et al. 2005_6
EukaryotaFusarium Sp.NADickschat 2017
EukaryotaAspergillus Sp.NADickschat 2017
ProkaryotaPseudomonas Putidanablack pepper rootSheoran et al. 2015
ProkaryotaPseudomonas Putidapositive influence of the plant root growth and protection against soil-borne pathogensNASheoran et al. 2015
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaPsychrobacillus VulpisNANAToral et al. 2021
ProkaryotaBacillus SubtilisNANALee et al. 2023
Citrobacter FreundiiTallon et al. 2023
Enterobacter AgglomeransTallon et al. 2023
Enterobacter CloacaeTallon et al. 2023
Klebsiella OxytocaTallon et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas AeruginosaLB brothSPME/GCxGC-MSno
ProkaryotaPseudomonas PutidaLuria Bertani Agarhead space GC/MSno
ProkaryotaBacillus SubtilisLB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTSB mediaHS-SPME/GC-MSno
ProkaryotaSulfitobacter Pontiacusn/an/ano
ProkaryotaLoktanella Hongkongensisn/an/ano
ProkaryotaRoseobacter Gallaeciensisn/an/ano
ProkaryotaSulfitobacter Sp.n/an/ano
ProkaryotaStappia Marinan/an/ano
ProkaryotaDinoroseobacter Shibaen/an/ano
ProkaryotaOceanibulbus Indolifexn/an/ano
EukaryotaFusarium Sp.no
EukaryotaAspergillus Sp.no
ProkaryotaPseudomonas PutidaLuria Bertani AgarHeadspace GC/MSno
ProkaryotaPseudomonas PutidaTSBPropak Q adsorbent trap/GC-MSno
ProkaryotaStaphylococcus EquorumMOLPHS-SPME-GC/MSno
ProkaryotaStaphylococcus Equorumtryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas Segetistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisMOLPHS-SPME-GC/MSno
ProkaryotaPsychrobacillus Vulpistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno
Citrobacter Freundiitryptone soya broth (TSB) mediaSPME/GC/MSno
Citrobacter Freundiitryptone soya broth (TSB) mediaTenax/GC/MSno
Enterobacter Agglomeranstryptone soya broth (TSB) mediaTenax/GC/MSno
Enterobacter Cloacaetryptone soya broth (TSB) mediaTenax/GC/MSno
Klebsiella Oxytocatryptone soya broth (TSB) mediaTenax/GC/MSno


3-ethyl-2,5-dimethylpyrazine

Mass-Spectra

Compound Details

Synonymous names
3-Ethyl-2,5-dimethylpyrazine
13360-65-1
2-Ethyl-3,6-dimethylpyrazine
Pyrazine, 3-ethyl-2,5-dimethyl-
2,5-DIMETHYL-3-ETHYLPYRAZINE
G2FB13VLOG
3,6-Dimethyl-2-ethylpyrazine
3,6-cocoa pyrazine
UNII-G2FB13VLOG
EINECS 236-417-1
CHEMBL95123
SCHEMBL160005
2E3,6DMP
2-ethyl-3,6-dimethyl pyrazine
DTXSID1065423
CHEBI:199156
Pyrazine, 2-ethyl-3,6-dimethyl
Pyrazine, 2-ethyl-3,?-dimethyl-
2-Ethyl-3,5/6-dimethyl-Pyrazine
AKOS006271522
BS-14917
DB-117250
FEMA NO. 3149, 3,6-DIMETHYL-
CS-0152557
NS00012398
F20894
A902157
W-108294
Q27278651
3-Ethyl-2,5-dimethylpyrazine; 2,5-Dimethyl-3-ethylpyrazine; 3,6-Dimethyl-2-ethylpyrazine;
Microorganism:

Yes

IUPAC name3-ethyl-2,5-dimethylpyrazine
SMILESCCC1=NC(=CN=C1C)C
InchiInChI=1S/C8H12N2/c1-4-8-7(3)9-5-6(2)10-8/h5H,4H2,1-3H3
FormulaC8H12N2
PubChem ID25916
Molweight136.19
LogP1.5
Atoms10
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds pyrazines heterocyclic compounds
CHEBI-ID199156
Supernatural-IDSN0410451

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANADixon et al. 2022
ProkaryotaBacillus Sp.antifungal activity against Fusarium solaniRhizosphere soil of avocadoGuevara-Avendaño et al. 2019
ProkaryotaPseudomonas Putidainhibitory activity against oomycete and fungal pathogens, antibacterial activity against R. pseudosolanacearum, dimethyl trisulphide nematicidal activity against R. similis, effect against Phytophthora rot on black pepper shoot cuttingsBlack pepper rootAgisha et al. 2019
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
ProkaryotaSerratia Fonticolaisolate from Irish potato soilsHeenan-Daly et al. 2021
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
ProkaryotaEscherichia ColiLeibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbHFitzgerald et al. 2020
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaStaphylococcus EpidermidisAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaPseudomonas Putidanablack pepper rootSheoran et al. 2015
ProkaryotaPseudomonas Putidapositive influence of the plant root growth and protection against soil-borne pathogensNASheoran et al. 2015
ProkaryotaLoktanella Sp.n/aNADickschat et al. 2005_4
ProkaryotaDinoroseobacter Shibaen/aNADickschat et al. 2005_4
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/aNASchulz and Dickschat 2007
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/aNADickschat et al. 2005_3
ProkaryotaSulfitobacter Pontiacusn/aNADickschat et al. 2005_6
ProkaryotaLoktanella Hongkongensisn/aNADickschat et al. 2005_6
ProkaryotaSulfitobacter Dubiusn/aNADickschat et al. 2005_6
ProkaryotaRoseobacter Gallaeciensisn/aNADickschat et al. 2005_6
ProkaryotaSulfitobacter Sp.n/aNADickschat et al. 2005_6
ProkaryotaDinoroseobacter Shibaen/aNADickschat et al. 2005_6
ProkaryotaOceanibulbus Indolifexn/aNADickschat et al. 2005_6
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
ProkaryotaStaphylococcus EquorumNANAToral et al. 2021
ProkaryotaBacillus AtrophaeusNANAToral et al. 2021
ProkaryotaPeribacillus Sp.NANAToral et al. 2021
ProkaryotaPseudomonas SegetisNANAToral et al. 2021
ProkaryotaBacillus VelezensisNANAToral et al. 2021
ProkaryotaPsychrobacillus VulpisNANAToral et al. 2021
ProkaryotaPseudomonas PutidaNANAPatel et al. 2020
ProkaryotaBacillus SubtilisNANALee et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBTD/GC-MSno
ProkaryotaBacillus Sp.LB agarSPME-GC-MSno
ProkaryotaPseudomonas PutidaLuria Bertani Agarhead space GC/MSno
ProkaryotaBacillus SubtilisLB agarGC-MSno
ProkaryotaPseudomonas FluorescensLB agarGC-MSno
ProkaryotaSerratia FonticolaTSB mediaSPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaPseudomonas AeruginosaTSB mediaHS-SPME/GC-MSno
ProkaryotaEscherichia ColiTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusLB media, TSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaStaphylococcus EpidermidisLB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaPseudomonas PutidaLuria Bertani AgarHeadspace GC/MSno
ProkaryotaPseudomonas PutidaTSBPropak Q adsorbent trap/GC-MSno
ProkaryotaLoktanella Sp.n/an/ano
ProkaryotaDinoroseobacter Shibaen/an/ano
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/an/ano
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/an/ano
ProkaryotaSulfitobacter Pontiacusn/an/ano
ProkaryotaLoktanella Hongkongensisn/an/ano
ProkaryotaSulfitobacter Dubiusn/an/ano
ProkaryotaRoseobacter Gallaeciensisn/an/ano
ProkaryotaSulfitobacter Sp.n/an/ano
ProkaryotaOceanibulbus Indolifexn/an/ano
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
ProkaryotaStaphylococcus Equorumtryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus AtrophaeusMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Atrophaeustryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.MOLPHS-SPME-GC/MSno
ProkaryotaPeribacillus Sp.tryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas SegetisMOLPHS-SPME-GC/MSno
ProkaryotaPseudomonas Segetistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaBacillus VelezensisMOLPHS-SPME-GC/MSno
ProkaryotaBacillus Velezensistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPsychrobacillus VulpisMOLPHS-SPME-GC/MSno
ProkaryotaPsychrobacillus Vulpistryptic soy agar (TSA, Panreac Applichem) mediumHS-SPME-GC/MSno
ProkaryotaPseudomonas PutidaLuria–Bertani agar (LBA)GC-MSno
ProkaryotaBacillus SubtilisTryptone soy broth (TSB)HPLCno


2-ethylpyrazine

Compound Details

Synonymous names
2-ETHYLPYRAZINE
Ethylpyrazine
13925-00-3
2-Ethyl-1,4-diazine
Pyrazine, ethyl-
2-ethyl pyrazine
Moldin
FEMA No. 3281
Pyrazine, 2-ethyl-
2-Ethyl-pyrazine
1392-50-3
0QO4LUV16Z
CHEBI:73232
FEMA 3281
MFCD00006149
CCRIS 2931
EINECS 237-691-5
UNII-0QO4LUV16Z
BRN 0108200
ethyl-pyrazine
ethylpyrazine, 2-
Ethylpyrazine, 98%
SCHEMBL12431
2-Ethylpyrazine;Ethylpyrazine
5-23-05-00402 (Beilstein Handbook Reference)
CHEMBL97525
2-ETHYLPYRAZINE [FHFI]
DTXSID2065676
2-Ethylpyrazine, >=98%, FG
Ethylpyrazine, analytical standard
AKOS003368474
CS-W021688
HY-W040948
AS-50068
PD158376
SY015220
DB-003654
AM20070410
E0334
NS00021635
EN300-95637
O10771
A807505
Q-100149
Q27140387
InChI=1/C6H8N2/c1-2-6-5-7-3-4-8-6/h3-5H,2H2,1H
Microorganism:

Yes

IUPAC name2-ethylpyrazine
SMILESCCC1=NC=CN=C1
InchiInChI=1S/C6H8N2/c1-2-6-5-7-3-4-8-6/h3-5H,2H2,1H3
FormulaC6H8N2
PubChem ID26331
Molweight108.14
LogP0.7
Atoms8
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationpyrazines nitrogen compounds aromatic compounds
CHEBI-ID73232
Supernatural-IDSN0196328

mVOC Specific Details

Boiling Point
DegreeReference
152 median
Vapor Pressure
PressureReference
1.67
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Staphylococcus AureusWang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Staphylococcus Aureusraw Shiyang chickenHS-GC-IMS/HS-SPME-GC-MSno


2-ethyl-6-methylpyrazine

Compound Details

Synonymous names
2-ETHYL-6-METHYLPYRAZINE
13925-03-6
Pyrazine, 2-ethyl-6-methyl-
2-Methyl-6-ethylpyrazine
2,6-Methylethylpyrazine
A9BL9OKQ7T
Pyrazine, 6-ethyl-2-methyl
PYRAZINE,2-ETHYL-6-METHYL-
UNII-A9BL9OKQ7T
EINECS 237-692-0
2-ethyl-6-methyl-pyrazine
SCHEMBL105987
CHEMBL4522941
FEMA NO. 3919
FEMA 3919
6-METHYL-2-ETHYLPYRAZINE
DTXSID60160977
CHEBI:193621
MFCD00055035
AKOS006283739
2-ETHYL-6-METHYLPYRAZINE [FHFI]
DS-20136
DB-116794
CS-0161293
NS00021636
D84033
EN300-300011
Q27273802
Microorganism:

Yes

IUPAC name2-ethyl-6-methylpyrazine
SMILESCCC1=NC(=CN=C1)C
InchiInChI=1S/C7H10N2/c1-3-7-5-8-4-6(2)9-7/h4-5H,3H2,1-2H3
FormulaC7H10N2
PubChem ID26332
Molweight122.17
LogP1
Atoms9
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds pyrazines heterocyclic compounds
CHEBI-ID193621
Supernatural-IDSN0319946

mVOC Specific Details

Boiling Point
DegreeReference
80 median

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStaphylococcus AureusLeibnitz 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
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaStaphylococcus EpidermidisAmerican Type Culture CollectionJenkins and Bean 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus EpidermidisTSB mediaHS-SPME/GC-MSno
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaStaphylococcus EpidermidisTSB mediaHS-SPME/GC×GC-TOFMSno