Results for:
chemical Classification: Furans

Furan-2-ylmethanol

Mass-Spectra

Compound Details

Synonymous names
Furfurylalcohol
formaldehyde copolymer
Furanmethanol
Furfuralcohol
Furfurylcarb
Furylcarbinol
furylmethanol
alpha-Furylcarbinol
Furfuranol
polyfurfuryl alcohol
XPFVYQJUAUNWIW-UHFFFAOYSA-N
2-Hydroxymethylfuran
2-hydroxymethylfurane
5-Hydroxymethylfuran
Furfural alcohol
FURFURYL ALCOHOL
FURFURYL ALCOHOL RESIN
Furyl alcohol
PFFA
2-furanemethanol
2-Furanylmethanol
2-Furfurylalkohol
poly-furfuryl alcohol
poly(furfurylalcohol)
2-Furancarbinol
2-Furanmethanol
2-Furylcarbinol
2-Furylmethanol
Furfuryl alcohol, analytical standard
Qo furfuryl alcohol
2-Hydroxymethyl-Furan
2-Furanmethanol, homopolymer
.alpha.-Furylcarbinol
2-Furane-methanol
2-Furfuryl alcohol
furan-2-ylmethanol
poly(furfuryl alcohol)
2-furan carbinol
AC1L1OL4
AC1Q7C2H
ACMC-20aiwg
Furan-2-methanol
Furylcarbinol (VAN)
2-(Hydroxymethyl)furan
.alpha.-Furfuryl alcohol
KSC234E7N
Furan-2-yl-methanol
NSC8843
PubChem19996
UN2874
(2-furyl)methanol
2-Furfurylalkohol [Czech]
CTK1D4276
F0076
Furfuryl alcohol, 98%
HSDB 711
AM81811
CHEMBL308187
omega-hydroxypoly(furan-2,5-diylmethylene) macromolecule
RL06102
STR01021
2-furylmethan-1-ol
C20441
CCRIS 2922
D582054MUH
(furan-2-yl)methanol
DTXSID2025347
HE027269
HE283278
HE341834
HE402089
HE402090
HE402091
LS-2036
NSC 8843
NSC-8843
omega-hydroxypoly(furan-2,5-diylmethylene)
SBB004373
UN 2874
(Fur-2-yl)methanol
A845784
CHEBI:53371
DSSTox_CID_5347
NCI-C56224
UNII-D582054MUH
WLN: T5OJ B1Q
ZINC1648266
AK-72801
AN-17685
ANW-75422
BR-72801
CJ-26639
DSSTox_GSID_25347
KB-52195
CHEBI:207496
DSSTox_RID_77760
Furfuryl alcohol, >=97%, FG
MFCD00003252
ZINC01648266
AI3-01171
DB-016149
ST50214441
TC-164167
TR-030270
(2-FURYL)-METHANOL (FURFURYLALCOHOL)
AKOS000119178
Epitope ID:136037
I14-7268
J-521401
BRN 0106291
FEMA No. 2491
FT-0668910
98-00-0
I14-22235
Z940713500
Furfuryl alcohol, natural, >=95%, FG
Tox21_202102
Tox21_303093
TRANSGENIC LECM (FURFURYL ALCOHOL) (SEE ALSO FURFURYL ALCOHOL)
F0001-2310
Methanol, (2-furyl)-
CAS-98-00-0
MCULE-4977977402
NCGC00249166-01
NCGC00256987-01
NCGC00259651-01
EINECS 202-626-1
25212-86-6
40795-25-3
88161-36-8
93793-62-5
767-EP2305688A1
767-EP2377610A2
767-EP2377611A2
767-EP2377849A2
Furfuryl alcohol [UN2874] [Poison]
MolPort-000-872-013
Furfuryl alcohol [UN2874] [Poison]
5-17-03-00338 (Beilstein Handbook Reference)
InChI=1/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H
IUPAC namefuran-2-ylmethanol
SMILESC1=COC(=C1)CO
InchiInChI=1S/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H2
FormulaC5H6O2
PubChem ID7361
Molweight98.101
LogP0.27
Atoms13
Bonds13
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationFuran Alcohols furans ethers

mVOC Specific Details

Volatilization
The Henry's Law constant for furfuryl alcohol is estimated as 7.9X10-8 atm-cu m/mole(SRC) derived from its vapor pressure, 0.609 mm Hg(1), and an assigned value for water solubility of 1X10+6 mg/L (miscible)(2). This Henry's Law constant indicates that furfuryl alcohol is expected to be essentially nonvolatile from water surfaces(3). Furfuryl alcohol's estimated Henry's Law constant indicates that volatilization from moist soil surfaces is not expected to occur(SRC). Furfuryl alcohol may volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1989) (2) McKillip WJ, Sherman E; in Kirk-Othmer Encycl Chem Tech 3rd ed 11: 499-527 (1978) (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
The Koc of furfuryl alcohol is estimated as 34(SRC), using a log Kow of 0.28(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that furfuryl alcohol is expected to have very high mobility in soil. The pKa of furfuryl alcohol is 9.55(4), indicating that this compound will primarily exist in its neutral form in the environment(5).
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. 13 (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) Serjeant EP, Dempsey B; Ionisation constants of organic acids in aqueous solution. IUPAC Chem Data Ser No.23. NY,NY: Pergamon pp. 989 (1979) (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)
Vapor Pressure
PressureReference
0.609 mm Hg at 25 deg C (est)Daubert, 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

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaKlebsiella Sp.n/aSchulz and Dickschat, 2007
BacteriaStreptomyces Spp.n/aSchulz and Dickschat, 2007
BacteriaPseudomonas Chlororaphis R47narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Fluorescens R76narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S04naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S24naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Vranovensis R01narhizosphere of field-grown potato plantsHunziker et al., 2015
Fungi Dickschat et al. 2011
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaKlebsiella Sp.n/an/a
BacteriaStreptomyces Spp.n/an/a
BacteriaPseudomonas Chlororaphis R47LB mediumGC/MSYes
BacteriaPseudomonas Fluorescens R76LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S04LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S24LB mediumGC/MSYes
BacteriaPseudomonas Vranovensis R01LB mediumGC/MSYes
Fungi no


2-(methoxymethyl)furan

Mass-Spectra

Compound Details

Synonymous names
Furfurylmethyl ether
GANSPRKOWQQXPE-UHFFFAOYSA-N
Furfuryl methyl ether
Methyl furfuryl ether
2-Methoxymethyl furan
AC1L1VOJ
2-furylmethyl methyl ether
RRM754RXFN
2-(Methoxymethyl)furan
2-Furfuryl methyl ether
UNII-RRM754RXFN
ACMC-1AZ1Z
METHYL, 2-FURANYLMETHOXY-
CTK3F1857
NSC35554
SCHEMBL872796
DTXSID8065581
FCH846086
HE311318
Furan, (methoxymethyl)-
HE308313
SCHEMBL9239311
HE025666
ZINC1668230
GEO-03174
CJ-27048
NSC 35554
NSC-35554
AN-18474
SCHEMBL13088437
AI3-23506
AKOS006276035
Furan, 2-(methoxymethyl)-
FEMA No. 3159
BBV-38282298
EINECS 237-176-5
97970-44-0
13679-46-4
IUPAC name2-(methoxymethyl)furan
SMILESCOCC1=CC=CO1
InchiInChI=1S/C6H8O2/c1-7-5-6-3-2-4-8-6/h2-4H,5H2,1H3
FormulaC6H8O2
PubChem ID61661
Molweight112.128
LogP0.91
Atoms16
Bonds16
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationFuran Ethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaChondromyces Crocatusn/aSchulz and Dickschat, 2007
Fungi Abraham et al. 1990
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaChondromyces Crocatusn/an/a
Fungi no


1-(5-methylfuran-2-yl)ethanone

Mass-Spectra

Compound Details

Synonymous names
KEFJLCGVTHRGAH-UHFFFAOYSA-N
AC1Q1JNK
ACMC-1BREJ
AC1L23ZO
5-Methyl-2-furylmethylketone
PubChem6971
KSC490Q2N
L146
2-ACETYL-5-METHYLFURAN
A0983
5-Methyl-2-acetylfuran
CTK3J0826
5-Acetyl-2-methylfuran
2-Methyl-5-acetylfuran
R1060
2-Acetyl 5-methylfuran
SCHEMBL183532
NSC80404
VZ35666
CHEMBL455506
IY49408H2O
BC218741
SBB046935
BBL027428
2-Acetyl-5-methylfuran, analytical standard
LS-2540
HE020735
STK502523
HE093033
ZINC1596545
UNII-IY49408H2O
2-acetyl 5-methyl furan
2-acetyl-5-methyl furan
2-Acetyl-5-methyl-furan
A804269
5-Methyl-2-acetyl furan
AJ-27857
TRA0050147
GEO-00034
Methyl 5-methyl-2-furyl ketone
NSC 80404
NSC-80404
DTXSID70152409
CJ-25611
CJ-05652
AK-77189
AB0004836
AC-23593
ANW-17323
AN-20645
ZINC01596545
CHEBI:562752
MFCD00003243
BB_SC-5466
ALBB-002841
DB-003537
TR-003258
RTR-003258
ST50945663
ST24026933
KB-173728
KB-197995
Q-100091
Z94598638
AKOS000119488
Epitope ID:136040
I14-0733
FT-0610962
Ketone, methyl 5-methyl-2-furyl
BRN 0110853
FEMA No. 3609
2-Acetyl-5-methylfuran, 98%
F0001-0319
Furan, 2-acetyl-5-methyl-
1-(5-Methyl-2-furanyl)ethanone
1-(5-methylfuran-2-yl)ethanone
1-(5-Methyl-2-furyl)ethanone
MCULE-9973272981
1193-79-9
EINECS 214-779-1
1-(5-Methyl-2-furyl)ethanone #
2-Acetyl-5-methylfuran, >=98%, FG
MolPort-001-769-615
1-(5-methyl-furan-2-yl)-ethanone
1-(5-methylfuran-2-yl)ethan-1-one
1-(5-Methyl-2-furyl)ethan-1-one
Ethanone, 1-(5-methyl-2-furanyl)-
5-17-09-00424 (Beilstein Handbook Reference)
InChI=1/C7H8O2/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H
IUPAC name1-(5-methylfuran-2-yl)ethanone
SMILESCC1=CC=C(O1)C(=O)C
InchiInChI=1S/C7H8O2/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3
FormulaC7H8O2
PubChem ID14514
Molweight124.139
LogP0.79
Atoms17
Bonds17
H-bond Acceptor1
H-bond Donor0
Chemical Classificationfurans ketones ethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Brevicompactumcompost Fischer et al. 2011
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Brevicompactumyest extract sucroseTenax/GC-MSno


1-(furan-2-yl)ethanone

Mass-Spectra

Compound Details

Synonymous names
Acetylfuran
IEMMBWWQXVXBEU-UHFFFAOYSA-N
2-acetylfurane
2-Furylethanone
Furyl methyl ketone
2-Acetylfuran
AC1Q1JXY
AC1L23YX
ACMC-1BPS0
PubChem6939
2-Acetyl furan
I896
KSC175C9R
Methyl 2-furyl ketone
2-Furyl methyl ketone
SCHEMBL43960
NSC4665
CTK0H5198
A0091
2-Aminomethyl-azetidine-1-carboxylic acid tert-butylester
1-Furan-2-ylmethanone
Q5ZRP80K02
NSC49133
2-Furyl methyl ketone, analytical standard
STR05504
AM91073
RP18952
ZINC157401
CCRIS 3161
Ketone, 2-furyl methyl
UNII-Q5ZRP80K02
NSC 4665
NSC-4665
PS-4586
SBB040248
HE110254
HE017372
STK400329
ZB006673
DTXSID0051601
BBL027427
CHEBI:59983
A804234
AJ-15008
NSC-49133
NSC 49133
1-Furan-2-yl-ethanone
LS-87211
KB-12200
SC-00529
AB1001236
AC-11853
ST2415091
AK-53418
Furan, 2-acetyl-
ANW-17304
AN-20640
TRA0078485
CJ-01650
1-(2-FURANYL)ETHANONE
1-(2-Furyl)ethanone
BB_SC-6820
2-Furyl methyl ketone (natural)
MFCD00003242
ZINC00157401
DB-003253
RTR-003241
AI3-23586
TR-003241
ST50213408
AKOS000119584
Epitope ID:136039
I14-0303
Q-100089
1-(2-Furyl)ethanone #
1-(furan-2-yl)ethanone
1-(2-Furanyl)-ethanone
2-Furyl methyl ketone, 99%
BRN 0107909
(2-furanyl)-1-ethanone
FEMA No. 3163
FT-0610977
I14-22249
Ethanone, 1-(furanyl)-
F0001-0316
1-(furan-2-yl)-ethanone
MCULE-6389695813
1192-62-7
EINECS 214-757-1
2-Furyl methyl ketone, >=99%, FG
80145-44-4
Ethanone, 1-(2-furanyl)-
1-(2-Furanyl)ethanone; 2-Furyl methyl ketone
1-(Furan-2-yl)ethan-1-one
MolPort-000-871-221
2-Furyl methyl ketone, natural (US), >=97%, FG
5-17-09-00381 (Beilstein Handbook Reference)
2-Furyl methyl ketone, purum, >=99.0% (GC)
InChI=1/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H
IUPAC name1-(furan-2-yl)ethanone
SMILESCC(=O)C1=CC=CO1
InchiInChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
FormulaC6H6O2
PubChem ID14505
Molweight110.112
LogP0.59
Atoms14
Bonds14
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationFuran Ketones furans ethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Ambifaria LMG 17828n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
BacteriaBurkholderia Ambifaria LMG 19182n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
BacteriaBurkholderia Ambifaria LMG 19467n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
BacteriaMyxobacterium Spp.n/aSchulz and Dickschat, 2007
BacteriaOctadecabacter Sp. ARK10255bn/aDickschat et al., 2005_3
BacteriaPseudomonas Chlororaphis R47narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Fluorescens R76narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S04naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S24naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Jessenii S34naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Syringae S22naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Veronii R02narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Vranovensis R01narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaStigmatella Aurantiaca DW4/3-1n/aDickschat et al., 2005_5
BacteriaStigmatella Aurantiaca Sg A15n/aDickschat et al., 2005_5
BacteriaStreptomyces Citreusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Sp. GWS-BW-H5.n/aDickschat et al., 2005_2
Fungi Dickschat et al. 2011
BacteriaPseudomonas Flureorescens SBW25Cheng et al. 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Ambifaria LMG 17828Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Ambifaria LMG 19182Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Ambifaria LMG 19467Luria-Bertani medium, Malt Extractn/a
BacteriaMyxobacterium Spp.n/an/a
BacteriaOctadecabacter Sp. ARK10255bn/an/a
BacteriaPseudomonas Chlororaphis R47LB mediumGC/MSYes
BacteriaPseudomonas Fluorescens R76LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S04LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S24LB mediumGC/MSYes
BacteriaPseudomonas Jessenii S34LB mediumGC/MSYes
BacteriaPseudomonas Syringae S22LB mediumGC/MSYes
BacteriaPseudomonas Veronii R02LB mediumGC/MSYes
BacteriaPseudomonas Vranovensis R01LB mediumGC/MSYes
BacteriaStigmatella Aurantiaca DW4/3-1n/an/a
BacteriaStigmatella Aurantiaca Sg A15n/an/a
BacteriaStreptomyces Citreusn/an/a
BacteriaStreptomyces Sp. GWS-BW-H5.n/an/a
Fungi no
BacteriaPseudomonas Flureorescens SBW25Kings B + rif,+kann; PDA GC-Q-TOF-MSno


2-butylfuran

Mass-Spectra

Compound Details

Synonymous names
NWZIYQNUCXUJJJ-UHFFFAOYSA-N
NWZIYQNUCXUJJJ-UHFFFAOYSA-
2-BUTYLFURAN
AC1L2GGS
2-Butylfuran, AldrichCPR
2-butyl furan
2-n-Butylfuran
81JV9ZYK0D
ACMC-1AD5K
OR3223
UNII-81JV9ZYK0D
Furan, butyl-
CTK1D6431
B2412
SCHEMBL256700
2-n-Butyl furan
PS-4850
DTXSID8073340
AK324207
HE019489
HE343745
CHEBI:89750
ZINC2037803
ANW-30174
CJ-32100
FCH1114917
Furan, 2-butyl-
ACM4466244
KB-85568
C-52872
ZX-AT005470
MFCD00047071
ZINC02037803
TC-118919
AKOS025396869
FT-0613148
I14-94392
2-(But-1-yl)furan
1-(Fur-2-yl)butane
4466-24-4
EINECS 224-732-7
MolPort-001-767-623
InChI=1/C8H12O/c1-2-3-5-8-6-4-7-9-8/h4,6-7H,2-3,5H2,1H3
IUPAC name2-butylfuran
SMILESCCCCC1=CC=CO1
InchiInChI=1S/C8H12O/c1-2-3-5-8-6-4-7-9-8/h4,6-7H,2-3,5H2,1H3
FormulaC8H12O
PubChem ID20534
Molweight124.183
LogP2.72
Atoms21
Bonds21
H-bond Acceptor0
H-bond Donor0
Chemical Classificationfurans ethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiAspergillus Flavus NRRL 18543n/aBeck et al., 2012
FungiAspergillus Flavus NRRL 25347n/aBeck et al., 2012
FungiAspergillus Niger NRRL 326n/aBeck et al., 2012
FungiAspergillus Parasiticus NRRL 5862n/aBeck et al., 2012
Fungi Bjerkandera AdustaZiegenbein et al 2010
FungiPenicillium Glabrum NRRL 766n/aBeck et al., 2012
FungiRhizopus Stolonifer NRRL 54667n/aBeck et al., 2012
FungiXylaria Sp.naHaematoxylon brasiletto, Morelos, MexicoSánchez-Ortiz et al., 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiAspergillus Flavus NRRL 18543potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Flavus NRRL 25347potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Niger NRRL 326potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Parasiticus NRRL 5862potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
Fungi Bjerkandera Adustano
FungiPenicillium Glabrum NRRL 766potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiRhizopus Stolonifer NRRL 54667potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiXylaria Sp.PDA mediumSPME-GC/MSYes


2-ethyl-5-methylfuran

Mass-Spectra

Compound Details

Synonymous names
NBXLPPVOZWYADY-UHFFFAOYSA-N
AC1L2LPO
AC1Q6ZH1
8739AA
2-Ethyl-5-methylfuran
2-Methyl-5-ethylfuran
CTK0I4245
SCHEMBL144611
AK123311
HE027925
FCH831781
CHEBI:88617
ZINC1995224
2-Ethyl-5-methyl-furan
DTXSID80168839
AX8247489
AJ-32274
KB-230411
AKOS006228280
I14-48848
Furan, 2-ethyl-5-methyl-
1703-52-2
EINECS 216-937-5
IUPAC name2-ethyl-5-methylfuran
SMILESCCC1=CC=C(O1)C
InchiInChI=1S/C7H10O/c1-3-7-5-4-6(2)8-7/h4-5H,3H2,1-2H3
FormulaC7H10O
PubChem ID74346
Molweight110.156
LogP2.04
Atoms18
Bonds18
H-bond Acceptor0
H-bond Donor0
Chemical Classificationfurans ethers heterocyclic compounds

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Crustosumn/aFischer et al., 1999
Fungi Nemcovic et al. 2009
BacteriaPseudomonas Flureorescens SBW25Cheng et al. 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Crustosumyeast extract sucrose agarn/a
Fungi no
BacteriaPseudomonas Flureorescens SBW25Kings B + rif,+kann; PDA GC-Q-TOF-MSno


2-ethylfuran

Mass-Spectra

Compound Details

Synonymous names
HLPIHRDZBHXTFJ-UHFFFAOYSA-N
alpha-Ethylfuran
a-Ethylfuran
2-Ethylfuran
2-Ethyloxole
ACMC-1ADVN
2-Ethylfuran, analytical standard
AC1L2CB0
2-ETHYL FURAN
KSC178K2D
FURAN, ETHYL-
OR6028
T8O6J71T9O
X6054
E0454
NE10273
VZ34666
UNII-T8O6J71T9O
CCRIS 4387
Jsp005947
CHEMBL2269084
HE334864
DTXSID7062906
HE009412
ZINC2037726
2-Ethylfuran, >=99%
A821123
AB1005929
TRA0002848
AN-21769
ANW-27261
CJ-07550
CJ-32094
2-Ethylfuran, 97%
GEO-01350
Furan, 2-ethyl-
ZINC02037726
MFCD00003259
ACN-S003344
KB-170354
LS-179535
RT-000854
I14-6304
W-106860
AKOS005254497
Furan, .alpha.-ethyl-
FEMA No. 3673
FT-0612271
Z1251171269
MCULE-6819919667
3208-16-0
EINECS 221-714-0
MolPort-001-769-736
InChI=1/C6H8O/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H
IUPAC name2-ethylfuran
SMILESCCC1=CC=CO1
InchiInChI=1S/C6H8O/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H3
FormulaC6H8O
PubChem ID18554
Molweight96.129
LogP1.84
Atoms15
Bonds15
H-bond Acceptor0
H-bond Donor0
Chemical Classificationethers furans heterocyclic compounds

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Crustosumcompost Fischer et al. 2005
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Crustosumyest extract sucroseTenax/GC-MSno
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS


Furan-2-carbaldehyde

Mass-Spectra

Compound Details

Synonymous names
Furancarboxaldehyde
Furfurylaldehyde
Furfuraldehyde
furfuraldehydl
Furaldehydes
Furancarbonal
alpha-Furfuraldehyde
Furaldehyde
Pyroligneous vinegar
FURFURAL
Furfurale
Furfurol
Furfurole
HYBBIBNJHNGZAN-UHFFFAOYSA-N
Pyroligneous acids
Pyromucic aldehyde
Quakeral
2-Furancarboxaldehyde
2-Furylcarboxaldehyde
Fufural
Furale
Furole
Pyroligneous acid extract
2-furancarbaldehyde
2-Furankarbaldehyd
Fural
Furol
Furyl-methanal
2-Furfuraldehyde
alpha-Furole
Furfural, analytical reference material
Qo furfural
WOOD VINEGAR
2-Formylofuran
2-Furanaldehyde
2-Furancarbonal
2-Furylaldehyde
2-Furylmethanal
Artificial ant oil
2-Formylfuran
2-Furaldehyde
2-furaldehydl
2-furan-carboxaldehyde
AC1Q6PVV
Bran oil
Fuf ural
Furan-2-carboxaldehyde
furan-2-carboxaldehydl
Wood Tar
2-Furfural
furan-2 carbaldehyde
furan-2-carbaldehyde
2-furanal
2-FURANCARBOXALDEHYDE, ACS
Artificial oil of ants
2-Furil-metanale
2-Furyl-methanal
AC1L1OL7
Ant Oil, artificial
furan-2-aldehyde
Furfurale [Italian]
2-Formyl furan
DJ1HGI319P
EBD294
Furfural (natural)
KSC214C0J
UNII-N4G9GAT76C component HYBBIBNJHNGZAN-UHFFFAOYSA-N
.alpha.-Furole
LS-28
NSC8841
UN1199
UNII-DJ1HGI319P
2-Furankarbaldehyd [Czech]
CTK1B4104
F0073
Furfural, 99%
HSDB 542
QSPL 006
QSPL 102
U1199
2-Formylofuran [Polish]
AM81812
BIDD:ER0698
CHEMBL189362
RL06103
STR00358
C14279
CCRIS 1044
DSSTox_CID_647
Rcra waste number U125
WLN: T5OJ BVH
DTXSID1020647
HE000135
NSC 8841
NSC-8841
SBB004386
STL283124
2-Furil-metanale [Italian]
A845786
ACMC-20978u
CHEBI:34768
Nci-C56177
ZINC3861345
ANW-13660
BP-31002
DSSTox_GSID_20647
KB-24259
SC-18048
TRA0077688
Caswell No. 466
Caswell No. 904
DSSTox_RID_75709
MFCD00003229
ZINC03861345
AI3-04466
DB-003668
Furfural, ACS reagent, 99%
LS-162370
RTC-069695
ST50213385
AKOS000118907
EPA Pesticide Chemical Code 043301
EPA Pesticide Chemical Code 067206
I14-0911
RCRA waste no. U125
BRN 0105755
FEMA No. 2489
FEMA No. 2967
FEMA No. 2968
FT-0627134
98-01-1
I14-22069
Tox21_111114
Tox21_202191
Tox21_300170
F1294-0048
Furfural, >=98%, FCC, FG
Furfural, for synthesis, 98.0%
CAS-98-01-1
Furaldehydes [UN1199] [Poison]
Furfural, SAJ first grade, >=99.0%
MCULE-5757882837
NCGC00091328-01
NCGC00091328-02
NCGC00091328-03
NCGC00091328-04
NCGC00253954-01
NCGC00259740-01
EINECS 202-627-7
EINECS 232-450-0
39276-09-0
Furfural, natural, >=98%, FCC, FG
2-Furaldehyde, 98% 250g
Furaldehydes [UN1199] [Poison]
MolPort-000-871-210
72277-EP2277848A1
72277-EP2308867A2
72277-EP2308870A2
5-17-09-00292 (Beilstein Handbook Reference)
InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4
IUPAC namefuran-2-carbaldehyde
SMILESC1=COC(=C1)C=O
InchiInChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H
FormulaC5H4O2
PubChem ID7362
Molweight96.085
LogP0.75
Atoms11
Bonds11
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationFuran Aldehydes Aldehyde furans ethers heterocyclic compounds

mVOC Specific Details

Volatilization
The Henry's Law constant for furfural is estimated as 3.8X10-6 atm-cu m/mole(SRC) derived from its vapor pressure, 2.21 mm Hg(1), and water solubility, 7.41X10+4 mg/L(2). This Henry's Law constant indicates that furfural is expected to volatilize 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 9.6 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)(3) is estimated as 73 days(SRC). Furfural's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of furfural from dry soil surfaces may exist(SRC) based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1989) (2) Yalkowsky SH, He Y, eds; Handbook of aqueous solubility data. Boca Raton, FL: CRC Press p. 140 (2003) (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
The Koc of furfural is estimated as 40(SRC), using a log Kow of 0.41(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that furfural is expected to have very high 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. 11 (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)
Vapor Pressure
PressureReference
2.21 mm Hg at 25 deg C (est)Daubert, 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

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBacillus Cereus B-569n/aBlom et al., 2011
BacteriaBurkholderia Andropogonis LMG 2129n/aBlom et al., 2011
BacteriaBurkholderia Caledonica LMG 19076n/aBlom et al., 2011
BacteriaBurkholderia Caryophylli LMG 2155n/aBlom et al., 2011
BacteriaBurkholderia Pyrrocinia LMG 21822n/aBlom et al., 2011
BacteriaBurkholderia Sacchari LMG 19450n/aBlom et al., 2011
BacteriaBurkholderia Sordidicola LMG 22029n/aBlom et al., 2011
BacteriaBurkholderia Terricola LMG 20594n/aBlom et al., 2011
BacteriaBurkholderia Thailandensis LMG 20219n/aBlom et al., 2011
BacteriaCellulomonas Udan/aBlom et al., 2011
BacteriaChromobacterium Violaceum CV0n/aBlom et al., 2011
BacteriaCupriavidus Necator LMG 1199n/aBlom et al., 2011
BacteriaEscherichia Coli OP50n/aBlom et al., 2011
BacteriaPandoraea Norimbergensis LMG 18379n/aBlom et al., 2011
BacteriaPseudomonas Aeruginosa PUPa3n/aBlom et al., 2011
BacteriaPseudomonas Chlororaphisn/aBlom et al., 2011
BacteriaPseudomonas Putida ISOfn/aBlom et al., 2011
BacteriaSerratia Entomophilia A1MO2n/aBlom et al., 2011
BacteriaSerratia Marcescens MG1n/aBlom et al., 2011
BacteriaSerratia Plymuthica HRO-C48n/aBlom et al., 2011
BacteriaSerratia Proteamaculans B5an/aBlom et al., 2011
BacteriaStenotrophomonas Rhizophilla Ep10-p69n/aBlom et al., 2011
FungiFusarium Culmorum PVnasandy dune soil, NetherlandsSchmidt et al., 2016
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaCytophaga-Flavobacterium-Bacteroides Group Strain ARK 10267n/aDickschat et al., 2005_3
Fungi Kikuchi et al. 1983
FungiCeratocystis Sp.Probably an active stimulator of germinatinon of uredospores of Puccinia graminis.Stotzky and Schenk, 1976
FungiFomitopsis PinicolanaGermanyRösecke et al., 2000
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiPuccinia Graminis Var. TriticiProbably an active stimulator of germinatinon of uredospores of Puccinia graminis.Stotzky and Schenk, 1976
FungiThielaviopsis BasicolaProbably an active stimulator of germinatinon of uredospores of Puccinia graminis.Stotzky and Schenk, 1976
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBacillus Cereus B-569MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Andropogonis LMG 2129MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caledonica LMG 19076MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caryophylli LMG 2155MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Pyrrocinia LMG 21822MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Sacchari LMG 19450MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Sordidicola LMG 22029AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Terricola LMG 20594MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Thailandensis LMG 20219AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaCellulomonas UdaLB and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaChromobacterium Violaceum CV0MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaCupriavidus Necator LMG 1199MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaEscherichia Coli OP50MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPandoraea Norimbergensis LMG 18379MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Aeruginosa PUPa3MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas ChlororaphisMS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Putida ISOfMSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Entomophilia A1MO2MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Marcescens MG1LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Plymuthica HRO-C48MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Proteamaculans B5aMSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaStenotrophomonas Rhizophilla Ep10-p69MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
FungiFusarium Culmorum PVwater agar supplied with artificial root exudatesGC/MS-Q-TOFNo
FungiTuber Aestivumn/an/a
BacteriaCollimonas Fungivorans Ter331sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCollimonas Pratensis Ter91sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCytophaga-Flavobacterium-Bacteroides Group Strain ARK 10267n/an/a
Fungi no
FungiCeratocystis Sp.n/an/a
FungiFomitopsis PinicolanaGC/MSNo
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiPuccinia Graminis Var. Triticin/an/a
FungiThielaviopsis Basicolan/an/a


2-heptylfuran

Mass-Spectra

Compound Details

Synonymous names
BHTUFJXTYNLISA-UHFFFAOYSA-N
2-HEPTYLFURAN
AC1L2EGQ
2-n-Heptylfuran
2-heptyl furan
OR3222
7W55A39QXM
Z5515
CTK1C4906
VZ25010
UNII-7W55A39QXM
CCRIS 6901
LP001637
SCHEMBL1868812
DTXSID2063187
A823864
CC-11606
ACM3777717
Furan, 2-heptyl-
KB-25670
ZINC95619429
MFCD00051820
ZX-AT008776
C-04815
ST50827809
DB-021419
AKOS005266535
FT-0612487
FEMA No. 3401
I14-106628
MCULE-4055197722
3777-71-7
EINECS 223-236-8
IUPAC name2-heptylfuran
SMILESCCCCCCCC1=CC=CO1
InchiInChI=1S/C11H18O/c1-2-3-4-5-6-8-11-9-7-10-12-11/h7,9-10H,2-6,8H2,1H3
FormulaC11H18O
PubChem ID19603
Molweight166.264
LogP4.06
Atoms30
Bonds30
H-bond Acceptor0
H-bond Donor0
Chemical Classificationethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTrichoderma Atroviridenawater damaged buildings, BelgiumPolizzi et al., 2012
FungiTrichoderma Viriden/aHung et al., 2013
FungiTrichoderma Atroviride ATCC 74058Stoppacher et al., 2010
FungiTrichoderma AtrovirideCrutcher et al., 2013
FungiTrichoderma ReeseiCrutcher et al., 2013
FungiTrichoderma VirensCrutcher et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTrichoderma Atroviridemalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MS
FungiTrichoderma Atroviride ATCC 74058Potato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma AtroviridePotato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma ReeseiPotato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma VirensPotato dextrose agarHS-SPME/GC-MS no


2-methylfuran-3-thiol

Mass-Spectra

Compound Details

Synonymous names
RUYNUXHHUVUINQ-UHFFFAOYSA-N
fish thiol
Oxycyclothione 030
AC1L1RB0
PubChem7060
2-Methyl-3-furylmercaptan
5086AH
3-Mercapto-2-methylfuran
2-methyl-3-sulfanylfuran
2-Methyl-3-mercaptofuran
CTK1A1847
2-Methylfuran-3-thiol
M1847
2-Methyl-3-furylthiol
2-Methyl-3-furanthiol
2-methyl-3-furanethiol
NE10680
ACMC-209h3f
EBD16869
SCHEMBL691744
VZ24915
N21RW1N179
2-methyl-3-mercaptofuran;
CHEMBL3188696
SBB066361
AK307148
DTXSID5047118
3-mercapto-2-methylfuran;
LS-2923
HE130870
HE000303
2-Methyl-3-mercapto furan
2-methyl-3-mercapto-furan
2 -methyl-3-furanthiol
2-methyl-3-furan thiol
UNII-N21RW1N179
2-methylfuran-3-thiol;
2-Methyl, 3-furanethiol
2-methyl-furan-3-thiol
2-methyl-3-thiol-furane
2-Methyl-3-furanthiol;
ANW-26425
DSSTox_GSID_47118
AB1005968
TRA0062495
TRA0070599
2-Methyl-3-furanthiol, technical grade
DSSTox_CID_27118
MFCD00010280
DSSTox_RID_82127
RT-002078
DB-021329
KB-173655
ZINC100013729
I09-0074
Furan-3-thiol, 2-methyl
Q-100360
AKOS015897434
3-FURANTHIOL, 2-METHYL-
2-methyl-furan-3-thiol;
FT-0612940
FEMA No. 3188
Tox21_302709
NCGC00256792-01
EINECS 249-094-7
2-METHYL-3-FURANETHIOL,CA.90%,BALANCE OXIDIZE D COMPOUND
28588-74-1
CAS-28588-74-1
2-Methyl-3-furanthiol, 95%, FG
MolPort-003-932-945
IUPAC name2-methylfuran-3-thiol
SMILESCC1=C(C=CO1)S
InchiInChI=1S/C5H6OS/c1-4-5(7)2-3-6-4/h2-3,7H,1H3
FormulaC5H6OS
PubChem ID34286
Molweight114.16
LogP1.41
Atoms13
Bonds13
H-bond Acceptor0
H-bond Donor1
Chemical Classificationthiols sulfur compounds ethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
FungiTuber 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
FungiTuber 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
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
FungiTuber Aestivumn/aGas chromatography-olfactometry (GC-O)
FungiTuber Melanosporumn/aGas chromatography-olfactometry (GC-O)


2-methylfuran

Mass-Spectra

Compound Details

Synonymous names
Methylfuran
alpha-Methylfuran
VQKFNUFAXTZWDK-UHFFFAOYSA-N
Sylvan
Silvan
2methylfuran
Methyl furan
2-METHYLFURAN
AC1L1VYQ
5-Methylfuran
FURAN,METHYL-
.alpha.-Methylfuran
2-Methylfuran, analytical standard
2-Methyl furan
2-METHYL-FURAN
H639
AC1Q2R63
NSC3707
NSC5211
PubChem11230
Silvan [Czech]
UN2301
Furan, methyl-
2-METHYLFURAN,99%,STABILIZED
51O3BGW3F2
CTK1A6077
M0226
RP18394
LS-197
UNII-51O3BGW3F2
CCRIS 2920
LTBB003942
HE020704
AK163149
HE140520
HE140521
HE349545
NSC 3707
NSC-3707
NSC-5211
STL264121
UN 2301
BC001078
CHEMBL1445555
DTXSID9025611
ZINC1666987
CHEBI:88912
ACMC-209l78
A829577
DSSTox_CID_5611
DSSTox_GSID_25611
ANW-31746
TRA0010438
CJ-27020
TRA0074450
AN-21295
KB-25115
WLN: T5OJ B1
Furan, 2-methyl-
MFCD00003248
DSSTox_RID_77854
ZINC01666987
DB-015962
ST24040899
RTC-040019
AI3-24245
J-510050
AKOS000120176
I14-6532
FT-0613043
BRN 0103733
Z940713482
2-Methylfuran, 99%, FG
2-Methylfuran, >=98%, stabilized with BHT
Tox21_200203
F0001-1386
534-22-5
NCGC00257757-01
NCGC00091686-02
NCGC00091686-01
MCULE-3620289319
CAS-534-22-5
EINECS 248-253-8
EINECS 208-594-5
27137-41-3
MolPort-019-317-114
2-Methylfuran [UN2301] [Flammable liquid]
2-Methylfuran [UN2301] [Flammable liquid]
5-17-01-00322 (Beilstein Handbook Reference)
2-Methylfuran, contains 200-400 BHT as stabilizer, 99%
InChI=1/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H
IUPAC name2-methylfuran
SMILESCC1=CC=CO1
InchiInChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3
FormulaC5H6O
PubChem ID10797
Molweight82.102
LogP1.31
Atoms12
Bonds12
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationFuran furans ethers heterocyclic compounds

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Sp. AD24bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaKlebsiella Pneumoniae ATCC 13883Rees et al. 2017
BacteriaPaenibacillus Sp. AD87bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaThermoactinomyces Spp.n/aSchulz and Dickschat, 2007
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
Fungi Nemcovic et al. 2008
FungiAspergillus VersicolorSchleibinger et al.,2005
FungiEurotium AmstelodamiSchleibinger et al.,2005
FungiPenicillium BrevicompactumSchleibinger et al.,2005
FungiTuber Borchiin/aFortywoodland of the Basilicata regionMauriello et al., 2004
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaStreptomycesJones et al. eLife 2017;6:e21738.
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Sp. AD24TSBAGC-Q-TOFno
BacteriaKlebsiella Pneumoniae ATCC 13883LBSPME / GCxGC-TOFMSno
BacteriaPaenibacillus Sp. AD87TSBAGC-Q-TOFno
BacteriaThermoactinomyces Spp.n/an/a
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
Fungi no
FungiAspergillus Versicoloringrain wallpaperGC/MS-SIMYes
FungiEurotium Amstelodamiingrain wallpaperGC/MS-SIMYes
FungiPenicillium Brevicompactumingrain wallpaperGC/MS-SIMYes
FungiTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaStreptomycesYPD agarGCxGC-TOFMSno


2-pentylfuran

Mass-Spectra

Compound Details

Synonymous names
YVBAUDVGOFCUSG-UHFFFAOYSA-N
2-PENTYLFURAN
AC1L2EGN
2-Amylfuran
6I0QAJ1JZQ
2-n-Pentylfuran
2-Pentylfuran, analytical standard
2-pentyl furan
PubChem7059
UNII-6I0QAJ1JZQ
ACMC-1CR6G
OR3220
Furan, pentyl-
4832AB
CTK1C2668
P1209
SCHEMBL221257
2-Pentylfuran (natural)
CCRIS 8807
HE019518
AK115089
LP031833
DTXSID9047679
LS-3020
CHEMBL3182720
A823863
ZINC1997926
2-(N-Pentyl)furan
CHEBI:89197
FCH1116834
DSSTox_GSID_47679
Furan, 2-pentyl-
CJ-30830
AX8077986
ANW-28727
AN-20963
ST2417147
AJ-32318
ACM3777693
MFCD00036497
ZINC01997926
ZX-AT008910
DSSTox_RID_82496
DSSTox_CID_27679
C-36409
KB-167424
ST51055140
DB-003325
RT-000871
W-106514
AKOS015913798
FEMA No. 3317
BRN 0107854
FT-0613265
2-Pentylfuran, >=98%, FG
Tox21_303542
NCGC00257337-01
3777-69-3
EINECS 223-234-7
64079-01-2
CAS-3777-69-3
MolPort-001-767-620
2-Pentylfuran, natural (US), >=97%, FG
5-17-01-00390 (Beilstein Handbook Reference)
IUPAC name2-pentylfuran
SMILESCCCCCC1=CC=CO1
InchiInChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3
FormulaC9H14O
PubChem ID19602
Molweight138.21
LogP3.17
Atoms24
Bonds24
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationFurans ethers heterocyclic compounds

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiAspergillus VersicolorSchleibinger et al.,2005
FungiChaetomium GlobosumSchleibinger et al.,2005
FungiEurotium AmstelodamiSchleibinger et al.,2005
FungiPenicillium BrevicompactumSchleibinger et al.,2005
FungiChaetomium Globosumwild strainsSchleibinger et al. 2005
FungiEurotium Amstelodamiwild strainsSchleibinger et al. 2005
FungiPenicillium Brevicompactumwild strainsSchleibinger et al. 2005
FungiXylaria Sp.naHaematoxylon brasiletto, Morelos, MexicoSánchez-Ortiz et al., 2016
Fungin/aFortywoodland of the Basilicata regionMauriello et al., 2004
Fungi Matsui et al. 2003
FungiNoneFortywoodland of the Basilicata regionMauriello et al., 2004
FungiArmillaria Mellean/aMueller et al., 2013
FungiAspergillus Flavus NRRL 18543n/aBeck et al., 2012
FungiAspergillus Flavus NRRL 25347n/aBeck et al., 2012
FungiAspergillus Niger NRRL 326n/aBeck et al., 2012
FungiAspergillus Parasiticus NRRL 5862n/aBeck et al., 2012
FungiFusarium Graminearum 15AcDONn/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON 1001tan/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON ZFR 29n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_4n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_5n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_6n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_7n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_8n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_9n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1002tn/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 11791n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1509n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 8046n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL38369n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL6394n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 15n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 37n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 51n/aBusko et al., 2014
FungiFusarium Graminearum NIVn/aBusko et al., 2014
FungiFusarium Graminearum NIV 357n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 119n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 23n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 48n/aBusko et al., 2014
FungiFusarium Graminearum NIV_5n/aBusko et al., 2014
FungiFusarium Graminearum NIV_6n/aBusko et al., 2014
FungiFusarium Graminearum NIV_7n/aBusko et al., 2014
FungiFusarium Graminearum NIV_8n/aBusko et al., 2014
FungiGanoderma Lucidumnasaprophytic on deciduous treesZiegenbein et al., 2006
FungiLaccaria Bicolorn/aMueller et al., 2013
FungiPaxillus Involutus MAJn/aMueller et al., 2013
FungiPaxillus Involutus NAUn/aMueller et al., 2013
FungiPenicillium Glabrum NRRL 766n/aBeck et al., 2012
FungiPholiota Squarrosan/aMueller et al., 2013
FungiPleurotus CystidiosusnanaUsami et al., 2014
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiRhizopus Stolonifer NRRL 54667n/aBeck et al., 2012
FungiSpongiporus Leucomallellusnasaprophytic mostly on wet, old pinesZiegenbein et al., 2006
FungiStropharia Rugosoannulatan/aMueller et al., 2013
FungiTrichoderma VirideHung et al., 2013
FungiTuber Aestivumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Excavatumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiVerticillium Longisporumn/aMueller et al., 2013
FungiFomitopsis PinicolanaGermanyRösecke et al., 2000
FungiTrametes Suaveolensnanear Zachersmühle, Göppingen, southern GermanyRösecke et al., 2000
FungiTuber AestivumnaTarsul (as normal forest); Daix (man made orchard)Molinier et al., 2015
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
FungiTrichoderma Atroviride ATCC 74058Stoppacher et al., 2010
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiAspergillus Versicoloringrain wallpaperGC/MS-SIMYes
FungiChaetomium Globosumingrain wallpaperGC/MS-SIMYes
FungiEurotium Amstelodamiingrain wallpaperGC/MS-SIMYes
FungiPenicillium Brevicompactumingrain wallpaperGC/MS-SIMYes
FungiChaetomium Globosumingrain (woodchip)SIM/GCMS / Tenaxno
FungiEurotium Amstelodamiingrain (woodchip)SIM/GCMS / Tenaxno
FungiPenicillium Brevicompactumingrain (woodchip)SIM/GCMS / Tenaxno
FungiXylaria Sp.PDA mediumSPME-GC/MSYes
Fungin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
Fungi no
FungiNonemicroextraction–gas chromatography–mass spectrometry analysis (SPME–GC–MS)No
FungiArmillaria MelleaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiAspergillus Flavus NRRL 18543potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Flavus NRRL 25347potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Niger NRRL 326potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Parasiticus NRRL 5862potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiFusarium Graminearum 15AcDONyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON 1001tayeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON ZFR 29yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_4yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_9yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1002tyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 11791yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1509yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 8046yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL38369yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL6394yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 15yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 37yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 51yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIVyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV 357yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 119yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 23yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 48yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_8yeast extract sucrose agarSPME/GC-MS
FungiGanoderma LucidumnaGC/MSNo
FungiLaccaria BicolorMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPaxillus Involutus MAJMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPaxillus Involutus NAUMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPenicillium Glabrum NRRL 766potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiPholiota SquarrosaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPleurotus CystidiosusnaGC/MS, GC-O, AEDANo
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiRhizopus Stolonifer NRRL 54667potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiSpongiporus LeucomallellusnaGC/MSNo
FungiStropharia RugosoannulataMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSYes
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
FungiVerticillium LongisporumMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiFomitopsis PinicolanaGC/MSNo
FungiTrametes SuaveolensnaGC/MSNo
FungiTuber AestivumnaSPME-GC/MSNo
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
FungiTrichoderma Atroviride ATCC 74058Potato dextrose agarHS-SPME/GC-MS no


2-phenylfuran

Compound Details

Synonymous names
GCXNJAXHHFZVIM-UHFFFAOYSA-N
GCXNJAXHHFZVIM-UHFFFAOYSA-
2-phenylfuran
AC1LAS78
2-Phenyl-furan
8800AA
PubChem19994
Furan, phenyl-
CTK0H3817
SCHEMBL162083
HE025514
FCH840805
BC214498
ZINC3133972
AX8078189
Furan, 2-phenyl-
ANW-71940
AK-60897
AJ-44574
DTXSID00333986
KB-25937
AC-18802
MFCD00234628
TC-160685
ACM17113336
ST24041016
AKOS006273368
FT-0082088
FT-0601934
I14-22149
17113-33-6
InChI=1/C10H8O/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H
IUPAC name2-phenylfuran
SMILESC1=CC=C(C=C1)C2=CC=CO2
InchiInChI=1S/C10H8O/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H
FormulaC10H8O
PubChem ID519363
Molweight144.173
LogP2.68
Atoms19
Bonds20
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationFurans ethers benzenoids

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTrichoderma AtrovirideCrutcher et al., 2013
FungiTrichoderma ReeseiCrutcher et al., 2013
FungiTrichoderma VirensCrutcher et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTrichoderma AtroviridePotato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma ReeseiPotato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma VirensPotato dextrose agarHS-SPME/GC-MS no


2,3,5-trimethylfuran

Compound Details

Synonymous names
NJXZFRUNHWKHEC-UHFFFAOYSA-N
AC1LAPIQ
CTK0I0305
SCHEMBL182910
2,3,5-Trimethylfuran
FCH921111
HE133706
ZINC2518855
X-4175
GEO-02420
DTXSID10146923
SCHEMBL10768398
MFCD03931179
ZINC02518855
2,3,5-Trimethylfuran #
AKOS005257003
FT-0609458
Furan, 2,3,5-trimethyl-
10504-04-8
MolPort-002-498-112
IUPAC name2,3,5-trimethylfuran
SMILESCC1=CC(=C(O1)C)C
InchiInChI=1S/C7H10O/c1-5-4-6(2)8-7(5)3/h4H,1-3H3
FormulaC7H10O
PubChem ID517859
Molweight110.156
LogP2.03
Atoms18
Bonds18
H-bond Acceptor0
H-bond Donor0
Chemical Classificationethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Brock et al. 2011
FungiAspergillus Candiduscompost Fischer et al. 2008
FungiPaecilomyces Variotiicompost Fischer et al. 2008
FungiPenicillium Crustosumcompost Fischer et al. 2008
FungiPenicillium Cyclopiumcompost Fischer et al. 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi no
FungiAspergillus Candidusyest extract sucroseTenax/GC-MSno
FungiPaecilomyces Variotiiyest extract sucroseTenax/GC-MSno
FungiPenicillium Crustosumyest extract sucroseTenax/GC-MSno
FungiPenicillium Cyclopiumyest extract sucroseTenax/GC-MSno


2,4-dimethylfuran

Mass-Spectra

Compound Details

Synonymous names
AABTWRKUKUPMJG-UHFFFAOYSA-N
2,4-DIMETHYLFURAN
AC1L2E64
Y6577
CTK1C4684
2,4-Dimethylfuran #
2,4-dimethyl-furan
2,4-dimethyl furan
HE027525
HE134124
CHEBI:89526
ZINC5362481
DTXSID50190602
KB-17640
AKOS015905551
Furan, 2,4-dimethyl-
I14-22349
3710-43-8
IUPAC name2,4-dimethylfuran
SMILESCC1=CC(=CO1)C
InchiInChI=1S/C6H8O/c1-5-3-6(2)7-4-5/h3-4H,1-2H3
FormulaC6H8O
PubChem ID19462
Molweight96.129
LogP1.83
Atoms15
Bonds15
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationFuran ethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
Fungi Brock et al. 2011
FungiFusarium Culmorum PVnasandy dune soil, NetherlandsSchmidt et al., 2016
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaCollimonas Fungivorans Ter331sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCollimonas Pratensis Ter91sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
Fungi no
FungiFusarium Culmorum PVpotato dextrose agarGC/MS-Q-TOFNo
FungiPaecilomyces Variotii BainMEAGC/MS


2,5-dimethylfuran

Mass-Spectra

Compound Details

Synonymous names
GSNUFIFRDBKVIE-UHFFFAOYSA-N
ACMC-1AVPG
DR5HL9OJ7Y
AC1L1Z7R
UNII-DR5HL9OJ7Y
2,5-Dimethylfurane
2,5-DIMETHYLFURAN
KSC357C4R
KM0638
NSC6220
D0725
CTK2F7148
OR28939
AM81813
STR09233
2,5-Dimethyl furane
2.5-dimethyl furan
CCRIS 3158
2,5-dimethyl-furan
2,5-Dimethyl furan
DTXSID7022093
HE027522
HE135432
HE135433
CHEMBL1416448
LS-1503
NSC 6220
NSC-6220
PS-9347
ZINC1693339
CHEBI:89052
DSSTox_CID_2093
AN-46837
ANW-34277
TL8004196
DSSTox_GSID_22093
CJ-06536
KB-18014
ZINC01693339
MFCD00003250
DSSTox_RID_76486
RTR-037326
KB-165395
AI3-21212
DB-015920
TR-037326
I14-7193
Q-100722
AKOS000120051
2,5-Dimethylfuran, >=99%
I14-1106
FT-0655041
2,5-Dimethylfuran, 99%
FT-0610466
Furan, 2,5-dimethyl-
WLN: T5OJ B1 E1
I14-22175
Tox21_202472
2,5-Dimethyl-13C2-furan
625-86-5
F0001-1679
NCGC00260021-01
NCGC00091694-01
MCULE-2776549830
CAS-625-86-5
EINECS 210-914-3
MolPort-016-633-152
InChI=1/C6H8O/c1-5-3-4-6(2)7-5/h3-4H,1-2H
IUPAC name2,5-dimethylfuran
SMILESCC1=CC=C(O1)C
InchiInChI=1S/C6H8O/c1-5-3-4-6(2)7-5/h3-4H,1-2H3
FormulaC6H8O
PubChem ID12266
Molweight96.129
LogP1.51
Atoms15
Bonds15
H-bond Acceptor0
H-bond Donor0
Chemical Classificationethers furans

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Sunesson et al. 1995
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPenicillium Crustosumcompost Fischer et al. 2006
FungiPenicillium Cyclopiumcompost Fischer et al. 2006
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi no
FungiPaecilomyces Variotii BainDG18GC/MS
FungiPenicillium Commune PittDG18GC/MS
FungiPenicillium Crustosumyest extract sucroseTenax/GC-MSno
FungiPenicillium Cyclopiumyest extract sucroseTenax/GC-MSno


Furan-3-carbaldehyde

Compound Details

Synonymous names
AZVSIHIBYRHSLB-UHFFFAOYSA-N
3-Furancarboxaldehyde
3furaldehyde
3-furancarbaldehyde
AC1Q6PYG
3-Formylfuran
3-Furaldehyde
Furan-3-carboxaldehyde
furan-3-carbaldehyde
AC1Q6Q9P
AC1L1V0K
PubChem6948
AMOT0244
ACMC-209kip
3-Furancarboxaldehyde, >=97%
CTK1D7099
F0354
AM85794
POB632X444
AK112724
SBB004385
HE009410
CHEMBL2228160
CS-M0782
K-9250
CHEBI:87609
UNII-POB632X444
ZINC2040441
KB-32045
GEO-01440
SC-04839
TRA0088950
CJ-32381
DTXSID40198076
BP-20266
ANW-30863
AN-45336
AB0064381
AB1003254
AJ-33230
ZINC02040441
MFCD00010424
DB-002732
TR-017889
RTR-017889
AKOS000289061
I14-0265
W-202882
FT-0615760
498-60-2
F2191-0143
3-Furaldehyde, 97%, stabilized 5g
MolPort-000-142-220
97525-EP2305679A1
97525-EP2284157A1
130840-EP2281812A1
130840-EP2295433A2
InChI=1/C5H4O2/c6-3-5-1-2-7-4-5/h1-4
IUPAC namefuran-3-carbaldehyde
SMILESC1=COC=C1C=O
InchiInChI=1S/C5H4O2/c6-3-5-1-2-7-4-5/h1-4H
FormulaC5H4O2
PubChem ID10351
Molweight96.085
LogP0.83
Atoms11
Bonds11
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationFurans aldehydes ethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo


3-methylfuran

Mass-Spectra

Compound Details

Synonymous names
KJRRQXYWFQKJIP-UHFFFAOYSA-N
2-Azacyclobutanone
3-methylfurane
3-METHYLFURAN
3-Methylfuran, AldrichCPR
3-methyl furan
3-methyl-furan
3-methyl-fura
AC1L221I
3-Methylfuran-methyl-D3
PubChem19993
X5961
3-methylfuran,98%
M0939
CTK3I8103
VZ35151
ACMC-20an04
NSC346905
HE142616
HE027296
X-4282
ZINC1580392
A844425
3-methylfuran (stabilized with hq)
CJ-25129
5R72A0440N
LS-70258
KB-32635
AN-48024
Furan, 3-methyl-
DTXSID10239228
FCH1116445
GEO-01834
ZINC01580392
MFCD00060134
NSC-346905
DB-016017
UNII-5R72A0440N
TR-029158
RTR-029158
NSC 346905
AKOS005255084
S14-0927
FT-0616160
FT-0671790
3-methylfuran, 98% 1gr
BRN 0104217
I14-22064
930-27-8
3-methylfuran (stabilized with hq) 98+%
MolPort-019-910-356
5-17-01-00330 (Beilstein Handbook Reference)
InChI=1/C5H6O/c1-5-2-3-6-4-5/h2-4H,1H
IUPAC name3-methylfuran
SMILESCC1=COC=C1
InchiInChI=1S/C5H6O/c1-5-2-3-6-4-5/h2-4H,1H3
FormulaC5H6O
PubChem ID13587
Molweight82.102
LogP1.63
Atoms12
Bonds12
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationFuran furans ethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiAspergillus FlavusSchnürer et al. 1999
FungiPenicillium BrevicompactumSchnürer et al. 1999
BacteriaStreptomyces Spp.n/aSchulz and Dickschat, 2007
Fungi Börjesson et al. 1990
FungiAspergillus VersicolorSchleibinger et al.,2005
FungiAspergillus Versicolor Tiraboschinadamp indoor environments, food productsSunesson et al., 1995
FungiChaetomium GlobosumSchleibinger et al.,2005
FungiCladosporium Cladosporioides Ellisnaindoor, outdoor, on a wide range of materialsSunesson et al., 1995
FungiEurotium AmstelodamiSchleibinger et al.,2005
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
FungiPenicillium Aurantiogriseumn/aBoerjesson et al., 1990
FungiPenicillium BrevicompactumSchleibinger et al.,2005
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiAspergillus Flavusmalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiPenicillium Brevicompactummalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
BacteriaStreptomyces Spp.n/an/a
Fungi no
FungiAspergillus Versicoloringrain wallpaperGC/MS-SIMYes
FungiAspergillus Versicolor TiraboschiDG18GC/MS
FungiChaetomium Globosumingrain wallpaperGC/MS-SIMYes
FungiCladosporium Cladosporioides EllisDG18GC/MS
FungiEurotium Amstelodamiingrain wallpaperGC/MS-SIMYes
FungiPaecilomyces Variotii BainDG18,MEAGC/MS
FungiPenicillium Aurantiogriseumn/an/a
FungiPenicillium Brevicompactumingrain wallpaperGC/MS-SIMYes
FungiPenicillium Commune PittDG18GC/MS


3-phenylfuran

Mass-Spectra

Compound Details

Synonymous names
BNANPEQZOWHZKY-UHFFFAOYSA-N
3-Phenylfuran
AC1LAR7H
3-phenyl-furan
CTK0F3745
HE308312
SCHEMBL1126802
AB1008212
DTXSID30333833
Furan, 3-phenyl-
ZINC32149389
AKOS015904821
I14-21924
I14-23332
13679-41-9
IUPAC name3-phenylfuran
SMILESC1=CC=C(C=C1)C2=COC=C2
InchiInChI=1S/C10H8O/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-8H
FormulaC10H8O
PubChem ID518802
Molweight144.173
LogP2.76
Atoms19
Bonds20
H-bond Acceptor0
H-bond Donor0
Chemical Classificationfurans ethers benzenoids

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber MelanosporumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber MelanosporumYes


4-(furan-3-yl)benzaldehyde

Compound Details

Synonymous names
QUGMHBNQYXZEIU-UHFFFAOYSA-N
CHEMBL250060
SCHEMBL610426
4-(3-Furanyl)benzaldehyde
4-furan-3-yl-benzaldehyde
ZINC15221740
4-(furan-3-yl)benzaldehyde
AKOS013264007
F2167-0775
IUPAC name4-(furan-3-yl)benzaldehyde
SMILESC1=CC(=CC=C1C=O)C2=COC=C2
InchiInChI=1S/C11H8O2/c12-7-9-1-3-10(4-2-9)11-5-6-13-8-11/h1-8H
FormulaC11H8O2
PubChem ID21526045
Molweight172.183
LogP2.47
Atoms21
Bonds22
H-bond Acceptor1
H-bond Donor0
Chemical Classificationbenzenoids furans ethers aldehydes

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Sarcodontia CroceaKokubun et al. 2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi Sarcodontia Crocea2D NMRno