Results for:
chemical Classification: epoxides

3,7,7,10-tetramethyl-2-oxatetracyclo[7.3.0.01,3.06,8]dodecane

Mass-Spectra

Compound Details

Synonymous names
Ledene oxide-(I)
OZNHATCGPKOFBH-UHFFFAOYSA-N
1,4a,7,7-Tetramethyldecahydrocyclopropa[7,8]azuleno[3a,4-b]oxirene
1,4a,7,7-Tetramethyldecahydrocyclopropa[7,8]azuleno[3a,4-b]oxirene #
Microorganism:

No

IUPAC name3,7,7,10-tetramethyl-2-oxatetracyclo[7.3.0.01,3.06,8]dodecane
SMILESCC1CCC23C1C4C(C4(C)C)CCC2(O3)C
InchiInChI=1S/C15H24O/c1-9-5-8-15-11(9)12-10(13(12,2)3)6-7-14(15,4)16-15/h9-12H,5-8H2,1-4H3
FormulaC15H24O
PubChem ID534497
Molweight220.35
LogP3.5
Atoms16
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers terpenes
Supernatural-IDSN0279342

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAHeddergott et al. 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusBrian FE supp.SPME/GC-MSno


2,7,7,10-tetramethyl-3-oxatetracyclo[7.3.0.02,4.06,8]dodecane

Compound Details

Synonymous names
Isoaromadendrene epoxide
GLKQAHXBJLGAFT-UHFFFAOYSA-N
1,3b,6,6-Tetramethyldecahydro-1H-cyclopropa[7,8]azuleno[4,5-b]oxirene
Q67879937
1,3b,6,6-Tetramethyldecahydro-1H-cyclopropa[7,8]azuleno[4,5-b]oxirene #
Microorganism:

No

IUPAC name2,7,7,10-tetramethyl-3-oxatetracyclo[7.3.0.02,4.06,8]dodecane
SMILESCC1CCC2C1C3C(C3(C)C)CC4C2(O4)C
InchiInChI=1S/C15H24O/c1-8-5-6-9-12(8)13-10(14(13,2)3)7-11-15(9,4)16-11/h8-13H,5-7H2,1-4H3
FormulaC15H24O
PubChem ID534398
Molweight220.35
LogP3.8
Atoms16
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers terpenes
Supernatural-IDSN0108848

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAHeddergott et al. 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusBrian FE supp.SPME/GC-MSno


(1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane

Compound Details

Synonymous names
Caryophyllene oxide
(-)-Caryophyllene oxide
1139-30-6
beta-Caryophyllene oxide
beta-Caryophyllene epoxide
(-)-Epoxycaryophyllene
Epoxycaryophyllene
trans-caryophyllene oxide
(-)Carophyllene oxide
UNII-S2XU9K448U
(-)-Epoxydihydrocaryophyllene
S2XU9K448U
Caryophylene oxide
HSDB 5466
EINECS 214-519-7
MFCD00134216
(-)-BETA-CARYOPHYLLENE EPOXIDE
CARYOPHYLLENE, EPOXIDE
CHEMBL508894
DTXSID4051586
FEMA NO. 4085
CHEBI:67818
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane
.beta.-Caryophyllene oxide
(1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane
4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane, (1R,4R,6R,10S)-
5-Oxatricyclo(8.2.0.0(4,6))dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
Caryophyllene Oxide 1000 microg/mL in Isopropanol
epoxide
(-)-.beta.-Caryophyllene epoxide
4-12,12-TRIMETHYL-9-METHYLENE-5-OXATRICYLO (8.2.0.04,6) DODECANE
(1R,4R,6R,10S)-4,12,12-TRIMETHYL-9-METHYLIDENE-5-OXATRICYCLO[8.2.0.0?,?]DODECANE
5-Oxatricyclo(8.2.0.04,6)dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
5-Oxatricyclo(8.2.0.0(sup 4,6))dodecane, 4,12,12-trimethyl-9-methylene-, (1R,4R,6R,10S)-
5-OXATRICYCLO(8.2.0.04,6)DODECANE, 4,12,12-TRIMETHYL-9-METHYLENE-, (1R-(1R*,4R*,6R*,10S*))-
ambar crystal
bcp oxide
(1R-(1R*,4R*,6R*,10S*))-4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane
?-caryophyllene oxide
b-Caryophyllene Epoxide
trimethyl(methylene)[?]
Caryophyllene Oxide 90001
SCHEMBL127077
DTXCID8030138
(-)-Caryophyllene oxide, 95%
NVEQFIOZRFFVFW-RGCMKSIDSA-N
4,12,12-trimethyl-9-methylene-
4beta,5alpha-EPOXYCARYOPHYLLENE
HY-N3544
Tox21_303807
BDBM50241720
CARYOPHYLLENE 4beta,5alpha-OXIDE
s3983
AKOS030241571
CARYOPHYLLENE 4beta,5alpha-EPOXIDE
CCG-208462
(1R,4R,6R,10S)-9-Methylene-4,12,12-trimethyl-5-oxatricyclo[8.2.0.04,6]dodecane
NCGC00357089-01
AS-58060
BETA-CARYOPHYLLENE EPOXIDE, (-)-
.BETA.-CARYOPHYLLENE OXIDE [FHFI]
CAS-1139-30-6
4.BETA.,5.ALPHA.-EPOXYCARYOPHYLLENE
CS-0023810
CARYOPHYLLENE 4.BETA.,5.ALPHA.-OXIDE
(-)-BETA-CARYOPHYLLENE EPOXIDE [HSDB]
C16908
CARYOPHYLLENE 4.BETA.,5.ALPHA.-EPOXIDE
E80731
SR-05000002236
SR-05000002236-2
W-108611
(-)-Caryophyllene oxide, analytical reference material
(1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene
Q27136294
inverted exclamation markY99.0% (sum of enantiomers, GC)
(-)-Caryophyllene oxide, >=99.0% (sum of enantiomers, GC)
(1R,4R,6R,10S)- 5-Oxatricyclo[8.2.0.0(4,6)-]dodecane
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
(-)-5-Oxatricyclo[8.2.0.0(4,6)]dodecane,4,12,12-trimethyl-9-methylene-
(1R,4R,6R,10S)-4,12,12-Trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
(1R,4R,6R,10S)-9-Methylene-4,12,12-trimethyl-5-oxatricyclo[8.2.0.0(4,6])dodecane
(1R,4R,6R,10S)- 4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.]dodecane (caryophyllene oxide) 5-Oxatricyclo(8.2.0.0(4,6))dodecane
[1R-(1R*,4R*,6R*,10S*)]- (-)-Epoxydihydrocaryophyllene (-)-<>-Caryophyllene epoxide (-)-<>-Caryophyllene oxide 4,11,11-Trimethyl-8-methylene-5-oxatr
[1R-(1R*,4R*,6R*,10S*)]- Caryophylene oxide Caryophyllene epoxide Caryophyllene oxyde Epoxycaryophyllene [1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5
5-OXATRICYCLO(8.2.0.0(4,6))DODECANE, 4,12,12-TRIMETHYL-9-METHYLENE-, (1R-(1R*,4R*,6R*,10S*))-
5-OXATRICYCLO(8.20.0(4,6))DODECANE, 4,12,12-TRIMETHYL-9-METHYLENE-, (1R,4R,6R,10S)-
Microorganism:

Yes

IUPAC name(1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane
SMILESCC1(CC2C1CCC3(C(O3)CCC2=C)C)C
InchiInChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1
FormulaC15H24O
PubChem ID1742210
Molweight220.35
LogP3.6
Atoms16
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds terpenes
CHEBI-ID67818
Supernatural-IDSN0256143-11

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaCandida AlbicansATCC MYA-2876, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida GlabrataATCC 90030, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida TropicalisATCC 750, American Type Culture CollectionCosta et al. 2020
EukaryotaTrichoderma VirideNAMoisan et al. 2021
EukaryotaAntrodia CinnamomeananaLu et al. 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaCandida AlbicansYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida GlabrataYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida TropicalisYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaTrichoderma Viride1/5th PDA mediumGC-MSno
EukaryotaAntrodia CinnamomeaPDAGC/MSyes


1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane

Mass-Spectra

Compound Details

Synonymous names
Limonene oxide
1195-92-2
Limonene epoxide
Limonene 1,2-epoxide
Limonene monoxide
1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane
Limonene 1,2-oxide
1,2-Epoxylimonene
1,2-Epoxy-p-menth-8-ene
7-Oxabicyclo[4.1.0]heptane, 1-methyl-4-(1-methylethenyl)-
p-Menth-8-ene, 1,2-epoxy-
4-Isopropenyl-1-methyl-7-oxabicyclo[4.1.0]heptane
1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane
CHEBI:16431
NSC12045
1-Methyl-4-(1-methylvinyl)-7-oxabicyclo(4.1.0)heptane
7-Oxabicyclo(4.1.0)heptane, 1-methyl-4-(1-methylethenyl)-
CCRIS 3763
EINECS 214-805-1
NSC 12045
AI3-24998
Limonene 1, 2-oxide
1-Methyl-4-(1-methylethenyl)-7-oxabicyclo(4.1.0)heptane
a limonene-1,2-epoxide
a 1,2-epoxymenth-8-ene
p-Menth-8-ene,2-epoxy-
SCHEMBL93297
3-isopropenyl-6-methyl-7-oxabicyclo[4.1.0]heptane
CHEMBL2268547
DTXSID50862594
13837-75-7
7-Oxabicyclo[4.1.0]heptane, 1-methyl-4-(1-methylethenyl)-, [1S-(1.alpha.,4.alpha.,6.alpha.)]-
BBL027497
MFCD00005127
MFCD00074770
NSC-12045
STK801933
AKOS006228851
MCULE-4064327350
SB44781
SY257451
VS-08553
DB-061578
CS-0442167
NS00041597
E83861
EN300-322402
(+)-LIMONENE OXIDE 97% MIXTURE OF CIS&
J-504945
Q27101901
Z1198147214
1-Methyl-4-(prop-1-en-2-yl)-7-oxa-bicyclo[4.1.0]Heptane
{7-Oxabicyclo[4.1.0]heptane,} 1-methyl-4-(1-methylethenyl)-
1-Methyl-4-(1-methylethenyl)-7-oxabicyclo[4.1.0]heptane, 9CI
4-isopropenyl-1-methyl-7-oxa-bicyclo[4.1.0]heptane, AldrichCPR
1-METHYL-4-(PROP-1-EN-2-YL)-7-OXABICYCLO[4.1.0]HEPTANE(TBC AS STABILIZER)
Microorganism:

Yes

IUPAC name1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane
SMILESCC(=C)C1CCC2(C(C1)O2)C
InchiInChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3
FormulaC10H16O
PubChem ID91496
Molweight152.23
LogP2.5
Atoms11
Bonds1
H-bond Acceptor1
H-bond Donor0
Chemical Classificationethers heterocyclic compounds epoxides oxides terpenes
CHEBI-ID35672
Supernatural-IDSN0041737

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaCarnobacterium Divergensn/aNAErcolini et al. 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaCarnobacterium Divergensn/an/ano


2-(2-methylpentan-2-yl)oxirane

Compound Details

Synonymous names
2-(2-methylpentan-2-yl)oxirane
53907-76-9
1,1-Dimethylbutyloxirane
Oxirane, (1,1-dimethylbutyl)-
SCHEMBL2821699
UGXGGUUTKZZWBN-UHFFFAOYSA-N
2-(1,1-Dimethylbutyl)oxirane #
DTXSID301009858
DB-300847
Microorganism:

Yes

IUPAC name2-(2-methylpentan-2-yl)oxirane
SMILESCCCC(C)(C)C1CO1
InchiInChI=1S/C8H16O/c1-4-5-8(2,3)7-6-9-7/h7H,4-6H2,1-3H3
FormulaC8H16O
PubChem ID549896
Molweight128.21
LogP2.5
Atoms9
Bonds3
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


3-methyl-7-oxabicyclo[4.1.0]heptane

Compound Details

Synonymous names
36099-51-1
4-METHYL-1,2-CYCLOHEXENE OXIDE
3-Methyl-7-oxabicyclo[4.1.0]heptane
MFCD09742280
4-METHYL-1,2-CYCLOHEXENEOXIDE
7-Oxabicyclo[4.1.0]heptane, 3-methyl-
4-Methyl-1,2-cyclohexene oxide, cis + trans
SCHEMBL716267
ULPDSNLBZMHGPI-UHFFFAOYSA-N
DTXSID501346737
AKOS000149212
AKOS017343173
AS-81457
3-Methyl-7-oxabicyclo[4.1.0]heptane #
4-Methyl-1,2-cyclohexene oxide,(cis+trans)
CS-0451652
Microorganism:

Yes

IUPAC name3-methyl-7-oxabicyclo[4.1.0]heptane
SMILESCC1CCC2C(C1)O2
InchiInChI=1S/C7H12O/c1-5-2-3-6-7(4-5)8-6/h5-7H,2-4H2,1H3
FormulaC7H12O
PubChem ID535184
Molweight112.17
LogP1.6
Atoms8
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


1-methyl-4-(2-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane

Compound Details

Synonymous names
Limonene dioxide
96-08-2
Limonene diepoxide
Dipentene dioxide
1-Methyl-4-(2-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
Dipentene oxide
Dipentene diepoxide
Unox 269
Unox epoxide 269
Epoxide 269
Unoxat epoxide 269
1,2,8,9-Diepoxylimonene
p-Menthane, 1,2:8,9-diepoxy-
diepoxylimonene
Menthane, 1,2:8,9-diepoxy-
.alpha.-Limonene diepoxide
1,2:8,9-DIEPOXY-P-MENTHANE
1-METHYL-4-(2-METHYLOXIRANYL)-7-OXABICYCLO[4.1.0]HEPTANE
NSC 30545
M6TUW5WEJ9
MLS002639331
1-Methyl-4-(2-methyloxiranyl)-7-oxabicyclo(4.1.0)heptane
7-Oxabicyclo[4.1.0]heptane, 1-methyl-4-(2-methyloxiranyl)-
NSC-30545
NSC-54753
1,9-Diepoxylimonene
7-Oxabicyclo(4.1.0)heptane, 1-methyl-4-(2-methyloxiranyl)-
1,9-Diepoxy-p-menthane
4-(1,2-Epoxy-1-methylethyl)-1-methyl-7-oxabicyclo(4.1.0)heptane
7-Oxabicyclo(4.1.0)heptane, 4-(1,2-epoxy-1-methylethyl)-1-methyl-
Menthane,2:8,9-diepoxy-
p-Menthane,2:8,9-diepoxy-
7-Oxabicyclo(4.1.0)heptane, 1-methyl-4-(2-methyl-2-oxiranyl)-
WLN: T36 BOTJ A1 E- BT3OTJ B1
UNII-M6TUW5WEJ9
7-Oxabicyclo[4.1.0]heptane,2-epoxy-1-methylethyl)-1-methyl-
4-(1,2-Epoxy-1-methylethyl)-1-methyl-7-oxabicyclo[4.1.0]heptane
HSDB 5298
6-methyl-3-(2-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
EINECS 202-475-1
BRN 0107989
AI3-26044
1,2:8,9-Diepoxylimonene
5-19-01-00324 (Beilstein Handbook Reference)
SCHEMBL215026
( not+/-)-Limonene diepoxide
1,2,8,9-diepoxy-p-menthane
CHEMBL1880461
NSC30545
NSC54753
AKOS006272591
LIMONENE 1,2:8,9-DIEPOXIDE
MCULE-8018911665
NCI60_002581
SMR001548776
DB-301487
1,2:8,9-DIEPOXY-P-MENTHANE [HSDB]
Q27283565
1,2-EPOXY-4-(2-METHYLOXIRANYL)-1-METHYLCYCLOHEXANE
1,2-EPOXY-1-METHYL-4-(1-METHYLEPOXYETHYL)CYCLOHEXANE
1-Methyl-4-(2-methyl-2-oxiranyl)-7-oxabicyclo[4.1.0]heptane #
Microorganism:

Yes

IUPAC name1-methyl-4-(2-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
SMILESCC12CCC(CC1O2)C3(CO3)C
InchiInChI=1S/C10H16O2/c1-9-4-3-7(5-8(9)12-9)10(2)6-11-10/h7-8H,3-6H2,1-2H3
FormulaC10H16O2
PubChem ID232703
Molweight168.23
LogP1.1
Atoms12
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds
Supernatural-IDSN0320750

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
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
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas Sp.LB mediaHS-SPME/GC-MSno


1-methyl-7-oxabicyclo[4.1.0]heptane

Compound Details

Synonymous names
1,2-Epoxy-1-methylcyclohexane
1713-33-3
1-Methyl-7-oxabicyclo[4.1.0]heptane
1-Methyl-1,2-epoxycyclohexane
1-Methylcyclohexene oxide
1,2-epoxy-1-methyl-cyclohexane
1-Methylepoxycyclohexane
1-Methylcyclohexene epoxide
7-Oxabicyclo[4.1.0]heptane, 1-methyl-
1-Methylcyclohexene 1,2-oxide
1-Methyl-1,2-cyclohexene oxide
MFCD11846121
7-Oxabicyclo[4.1.0]heptane, methyl-
NSC-12597
SCHEMBL1262673
DTXSID20873233
NSC12597
1-methyl-7-oxabicyclo[4.1.0]heptan
AKOS024015279
PB48889
BS-52385
SY054336
1-Methyl-7-oxabicyclo[4.1.0]heptane #
DB-238286
CS-0152704
M1983
EN300-86196
T71914
J-640018
J-800019
Z1255380027
Microorganism:

Yes

IUPAC name1-methyl-7-oxabicyclo[4.1.0]heptane
SMILESCC12CCCCC1O2
InchiInChI=1S/C7H12O/c1-7-5-3-2-4-6(7)8-7/h6H,2-5H2,1H3
FormulaC7H12O
PubChem ID224243
Molweight112.17
LogP1.4
Atoms8
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


5,8,8-trimethyl-3-oxatricyclo[5.1.0.02,4]octane

Compound Details

Synonymous names
27867-36-3
PNJ58HM5VB
5,8,8-Trimethyl-3-oxatricyclo(5.1.0.02,4)octane
3-Oxatricyclo(5.1.0.02,4)octane, 5,8,8-trimethyl-
3-Oxatricyclo[5.1.0.02,4]octane, 5,8,8-trimethyl-
5,8,8-Trimethyl-3-oxatricyclo[5.1.0.0~2,4~]octane
5,8,8-TRIMETHYL-3-OXATRICYCLO[5.1.0.02,4]OCTANE
EINECS 248-701-2
car-4-ene oxide
UNII-PNJ58HM5VB
Carane, 4,5-epoxy-, trans
SCHEMBL10627107
DTXSID00950551
NS00049748
Microorganism:

Yes

IUPAC name5,8,8-trimethyl-3-oxatricyclo[5.1.0.02,4]octane
SMILESCC1CC2C(C2(C)C)C3C1O3
InchiInChI=1S/C10H16O/c1-5-4-6-7(10(6,2)3)9-8(5)11-9/h5-9H,4H2,1-3H3
FormulaC10H16O
PubChem ID119627
Molweight152.23
LogP2.4
Atoms11
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


2-pentyloxirane

Compound Details

Synonymous names
1,2-Epoxyheptane
5063-65-0
2-Pentyloxirane
Pentyloxirane
1-Heptene oxide
1,2-Heptylene Oxide
Oxirane, pentyl-
Heptene 1,2-oxide
Heptane, 1,2-epoxy-
Heptylene oxide
(R)-1,2-EPOXYHEPTANE
Heptane,2-epoxy-
2-Pentyloxirane #
NSC 24250
(+)-1,2-epoxyheptane
SCHEMBL50924
DTXSID30911736
NSC24250
MFCD00037521
NSC-24250
AKOS009157136
BS-22663
CS-0205209
E0312
T72538
EN300-1852162
InChI=1/C7H14O/c1-2-3-4-5-7-6-8-7/h7H,2-6H2,1H
Microorganism:

Yes

IUPAC name2-pentyloxirane
SMILESCCCCCC1CO1
InchiInChI=1S/C7H14O/c1-2-3-4-5-7-6-8-7/h7H,2-6H2,1H3
FormulaC7H14O
PubChem ID92215
Molweight114.19
LogP2.5
Atoms8
Bonds4
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides ethers heterocyclic compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaLactobacillus PlantarumNANAZhang et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaLactobacillus Plantarumchickpea milkUHPLC/MSno


(E)-3-[(2S,3S)-3-pentyloxiran-2-yl]prop-2-enal

Compound Details

Synonymous names
4,5-Epoxydec-2(trans)-enal
134454-31-2
FEMA No. 4037
3-(3-PENTYLOXIRANYL)-2E-PROPENOL
trans-4,5-Epoxy-(E)-2-decenal
4,5-Epoxy-2-decenal, (2E)-
(E)-3-[(2S,3S)-3-pentyloxiran-2-yl]prop-2-enal
2-Propenal, 3-(3-pentyloxiranyl)-, (E)-
3-(3-Pentyloxiran-2-yl) prop-(E)-2-enal
2-Propenal, 3-(3-pentyloxiranyl)-, (2E)-
B9K240ZU36
3-((2R,3R)-3-Pentyloxiranyl)2-propenal, (2E)-
2-Propenal, 3-((2R,3R)-3-pentyloxiranyl)-, (2E)-
2-Propenal, 3-((2R,3R)-3-pentyl-2-oxiranyl)-, (2E)-
4,5-epoxy-(E)-2-decenal
2-Propenal, 3-(3-pentyl-2-oxiranyl)-, (2E)-
trans-4,5-epoxy-2(E)-Decenal
UNII-B9K240ZU36
4,5-Epoxy-(E)-2-decenal [FIFH]
SCHEMBL1695461
2-Propenal, 3-(3-pentyloxiranyl)-, (2alpha(E),3beta)-
DTXSID50928629
HIOMEXREAUSUBP-MLXLLJIISA-N
AKOS040755302
4,5-EPOXY-(E)-2-DECENAL [FHFI]
4,5-EPOXY-(E)-2-DECENAL, TRANS-
rel-(2E)-3-[(2R,3R)-3-Pentyl-2-oxiranyl]-2-propenal
2-PROPENAL, 3-(3-PENTYLOXIRANYL)-, (2.ALPHA.(E),3.BETA.)-
Microorganism:

Yes

IUPAC name(E)-3-[(2S,3S)-3-pentyloxiran-2-yl]prop-2-enal
SMILESCCCCCC1C(O1)C=CC=O
InchiInChI=1S/C10H16O2/c1-2-3-4-6-9-10(12-9)7-5-8-11/h5,7-10H,2-4,6H2,1H3/b7-5+/t9-,10-/m0/s1
FormulaC10H16O2
PubChem ID15825667
Molweight168.23
LogP2
Atoms12
Bonds6
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaldehydes epoxides ethers heterocyclic compounds

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno


2-nonyloxirane

Compound Details

Synonymous names
2-Nonyloxirane
1,2-Epoxyundecane
17322-97-3
1-undecene oxide
2-nonyl-oxirane
2-Nonyloxirane #
SCHEMBL50887
DTXSID90336986
AKOS015905873
Microorganism:

Yes

IUPAC name2-nonyloxirane
SMILESCCCCCCCCCC1CO1
InchiInChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-11-10-12-11/h11H,2-10H2,1H3
FormulaC11H22O
PubChem ID537737
Molweight170.29
LogP4.6
Atoms12
Bonds8
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides heterocyclic compounds oxides ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas Veroniinarhizosphere of field-grown potato plantsHunziker et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas VeroniiLB mediumGC/MSyes


2,7,7-trimethyl-3-oxatricyclo[4.1.1.02,4]octane

Mass-Spectra

Compound Details

Synonymous names
alpha-Pinene oxide
2,3-Epoxypinane
1686-14-2
alpha-Pinene epoxide
2-Pinene oxide
Pinane, 2,3-epoxy-
Pinene oxide
alpha-Pineneoxide
.alpha.-Pinene oxide
.alpha.-Pinene epoxide
3-Oxatricyclo[4.1.1.02,4]octane, 2,7,7-trimethyl-
2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octane
Pinane, 2,3-epoxy-, (-)-
2,3-Epoxy-pinane
alpha-Pinene 2,3-oxide
CHEBI:29060
Pinane,3-epoxy-
NSC12148
3-Oxatricyclo[4.1.1.0(2,4)]octane, 2,7,7-trimethyl-
Pinane,3-epoxy-, (-)-
2,7,7-Trimethyl-3-oxatricyclo(4.1.1.02,4)octane
2,7,7-trimethyl-3-oxatricyclo[4.1.1.0(2,4)]octane
3-Oxatricyclo(4.1.1.02,4)octane, 2,7,7-trimethyl-
a-Pinene Oxide
CCRIS 3762
3-Oxatricyclo[4.1.1.02, 2,7,7-trimethyl-
NSC 5609
EINECS 216-869-6
NSC 12148
BRN 0080362
Alpha-pinane oxide
I+/--Pinene oxide
2,7,7-Trimethyl-3-oxatricyclo(4.1.1.0(sup 2,4))octane
?-PINENE OXIDE
3-Oxatricyclo(4.1.1.0(sup 2,4))octane, 2,7,7-trimethyl-
bmse000491
.alpha.-Pinene 2,3-oxide
SCHEMBL93429
5-17-01-00426 (Beilstein Handbook Reference)
218308_ALDRICH
CHEMBL274511
DTXSID5051781
NSC5609
NSC-5609
NSC-12148
NSC407160
AKOS015916312
HY-W130074
MCULE-1107037130
NSC-407160
AS-68305
CS-0188178
NS00123845
P1362
D97335
W-109695
Q27104051
2,7,7-Trimethyl-3-oxatricyclo[4.1.1.0~2,4~]octane
{3-Oxatricyclo[4.1.1.02,4]octane,} 2,7,7-trimethyl-
2,7,7-TRIMETHYL-3-OXATRICYCLO[4.1.1.0(2),?]OCTANE
Microorganism:

No

IUPAC name2,7,7-trimethyl-3-oxatricyclo[4.1.1.02,4]octane
SMILESCC1(C2CC1C3(C(C2)O3)C)C
InchiInChI=1S/C10H16O/c1-9(2)6-4-7(9)10(3)8(5-6)11-10/h6-8H,4-5H2,1-3H3
FormulaC10H16O
PubChem ID91508
Molweight152.23
LogP2.1
Atoms11
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationheterocyclic compounds epoxides oxides ethers terpenes
CHEBI-ID29060
Supernatural-IDSN0252360

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaGanoderma Lucidumnasaprophytic on deciduous treesCampos Ziegenbein et al. 2006
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaGanoderma LucidumnaGC/MSno


1-(3-methyloxiran-2-yl)ethanone

Compound Details

Synonymous names
17257-79-3
1-(3-methyloxiran-2-yl)ethanone
3,4-epoxy-2-pentanone
2-Pentanone, 3,4-epoxy-
2beta-Acetyl-3alpha-methyloxirane
Ethanone, 1-(3-methyloxiranyl)-
1-(3-METHYLOXIRANYL)ETHANONE
SCHEMBL11881829
DTXSID60938173
IAHUKWSQLBRAIN-UHFFFAOYSA-N
1-(3-methyloxiran-2-yl)ethan-1-one
3,4-Anhydro-1,5-dideoxypent-2-ulose
3,4-Anhydro-1,5-dideoxypent-2-ulose #
Microorganism:

Yes

IUPAC name1-(3-methyloxiran-2-yl)ethanone
SMILESCC1C(O1)C(=O)C
InchiInChI=1S/C5H8O2/c1-3(6)5-4(2)7-5/h4-5H,1-2H3
FormulaC5H8O2
PubChem ID28429
Molweight100.12
LogP0.1
Atoms7
Bonds1
H-bond Acceptor2
H-bond Donor0
Chemical Classificationepoxides heterocyclic compounds ketones ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaBacillus PumilusNAMülner et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaBacillus Pumilusnutrient agarHS-SPME/GC-MSno


4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one

Compound Details

Synonymous names
3-Buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-
3-Buten-2-one, 4-(2,2,6-trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)-
beta-ionone 5,6-epoxide
EINECS 245-542-0
5,6-beta-Ionone epoxide
DTXSID8051885
4-(1,2-Epoxy-2,6,6-trimethylcyclohexyl)-3-butenone-2
WLZ3135
ZTJZJYUGOJYHCU-UHFFFAOYSA-N
DB-282879
NS00013296
Q27159719
4-(2,6,6-trimethyl-1,2-epoxycyclohexyl)-3-buten-2-one
Microorganism:

Yes

IUPAC name4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
SMILESCC(=O)C=CC12C(CCCC1(O2)C)(C)C
InchiInChI=1S/C13H20O2/c1-10(14)6-9-13-11(2,3)7-5-8-12(13,4)15-13/h6,9H,5,7-8H2,1-4H3
FormulaC13H20O2
PubChem ID90899
Molweight208.3
LogP2
Atoms15
Bonds2
H-bond Acceptor2
H-bond Donor0
Chemical Classificationheterocyclic compounds epoxides ketones ethers terpenes
CHEBI-ID87546
Supernatural-IDSN0479774

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/aNADickschat et al. 2005_3
ProkaryotaCalothrix Sp.n/aNASchulz and Dickschat 2007
ProkaryotaPlectonema Sp.n/aNASchulz and Dickschat 2007
ProkaryotaPhormidium Sp.n/aNASchulz and Dickschat 2007
ProkaryotaSpirulina Platensisn/aNASchulz and Dickschat 2007
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/aNASchulz and Dickschat 2007
ProkaryotaCyanobacteria Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaCalothrix Parietinan/aNAHoeckelmann et al. 2004
ProkaryotaCalothrix Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaPlectonema Notatumn/aNAHoeckelmann et al. 2004
ProkaryotaPlectonema Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaTolypothrix Distortan/aNAHoeckelmann et al. 2004
ProkaryotaRivularia Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaRivularia Sp./Calothrix Parietinan/aNAHoeckelmann et al. 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaCytophaga-Flavobacterium-Bacteroidesn/an/ano
ProkaryotaCalothrix Sp.n/an/ano
ProkaryotaPlectonema Sp.n/an/ano
ProkaryotaPhormidium Sp.n/an/ano
ProkaryotaSpirulina Platensisn/an/ano
ProkaryotaCytophaga-Flavobacteria-Bacteroides Groupn/an/ano
ProkaryotaCyanobacteria Sp.n/an/ano
ProkaryotaCalothrix Parietinan/an/ano
ProkaryotaPlectonema Notatumn/an/ano
ProkaryotaTolypothrix Distortan/an/ano
ProkaryotaRivularia Sp.n/an/ano
ProkaryotaRivularia Sp./Calothrix Parietinan/an/ano


2,3-dimethyloxirane

Compound Details

Synonymous names
2,3-Epoxybutane
2,3-Dimethyloxirane
3266-23-7
2-Butene oxide
Oxirane, 2,3-dimethyl-
2,3-BUTYLENE OXIDE
Butane, 2,3-epoxy-
beta-Oxybutene
2-Butene expoxide
beta-Butylene oxide
2,3-Dimethyloxirane cis+trans
meso-2,3-Epoxybutane
(z)-2,3-epoxybutane
CCRIS 6033
2,3-Dimethyl-oxirane (Z)
EINECS 221-877-8
Pseudobutylene Oxide
Oxirane, 2,3-dimethyl-, (2R,3R)-rel-
(e)-2,3-epoxybutane
EC 221-877-8
Butane, 2,3-epoxy, trans-
DTXSID5025239
MFCD00137387
AKOS015899847
8-ACETAMIDONAPHTHALEN-2-YLACETATE
SY224137
B0720
NS00002698
EN300-96226
A821360
2,3-Dimethyloxirane, cis+trans, >=97.0% (GC)
J-018826
Q58824552
63864-69-7
Microorganism:

Yes

IUPAC name2,3-dimethyloxirane
SMILESCC1C(O1)C
InchiInChI=1S/C4H8O/c1-3-4(2)5-3/h3-4H,1-2H3
FormulaC4H8O
PubChem ID18632
Molweight72.11
LogP0.7
Atoms5
Bonds0
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides heterocyclic compounds ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Meyerozyma GuilliermondiiXiong et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno
Meyerozyma GuilliermondiiYEPD, 10 g/L yeast extrac, 20 g/L peptone, 20 g dextroseGC-MS and GC-IMSno


2-hexyloxirane

Compound Details

Synonymous names
1,2-EPOXYOCTANE
2984-50-1
2-Hexyloxirane
Hexyloxirane
1-Octene oxide
Oxirane, hexyl-
Octylene epoxide
1-Octene epoxide
Octane 1,2-oxide
Octene-1,2-oxide
1,2-Epoxy-n-octane
n-Octene-1,2-oxide
Octane, 1,2-epoxy-
Epoxyoctane
Oktylenoxid
1,2-Octylene oxide
1,2-Epoxyoktan
2-hexyl-oxirane
NSC 24246
.alpha.-Epoxyoctane
1,2-Epoxyoctane purum
alpha-Epoxyoctane
26637-94-5
Oktylenoxid [Czech]
1,2-Epoxyoktan [Czech]
Octane, epoxy-
CCRIS 3797
EINECS 221-047-5
BRN 0079912
octene oxide
n-Hexyloxirane
AI3-14197
1,2 epoxyoctane
Octane,2-epoxy-
1,2-epoxy octane
1,2-epoxy-octane
1,2-Epoxyoctane, 96%
WLN: T3OTJ B6
SCHEMBL39393
5-17-01-00138 (Beilstein Handbook Reference)
NJWSNNWLBMSXQR-UHFFFAOYSA-
DTXSID301031190
NSC24246
BBL027501
MFCD00005157
NSC-24246
STL373784
AKOS009158672
MCULE-5253323325
AS-48232
BP-26283
PD193090
CS-0152296
E0206
NS00048797
1,2-Epoxyoctane, purum, >=95.0% (GC)
EN300-157817
F20386
J-640005
J-640383
J-660062
J-800005
Z1020680070
InChI=1/C8H16O/c1-2-3-4-5-6-8-7-9-8/h8H,2-7H2,1H3
Microorganism:

Yes

IUPAC name2-hexyloxirane
SMILESCCCCCCC1CO1
InchiInChI=1S/C8H16O/c1-2-3-4-5-6-8-7-9-8/h8H,2-7H2,1H3
FormulaC8H16O
PubChem ID18126
Molweight128.21
LogP3
Atoms9
Bonds5
H-bond Acceptor1
H-bond Donor0
Chemical Classificationepoxides heterocyclic compounds ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStreptomyces ThermocarboxydusNANAPassari et al. 2019
ProkaryotaLactobacillus PlantarumNANAZhang et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStreptomyces Thermocarboxydusactinomycetes isolation agar (AIA)GC-MSno
ProkaryotaLactobacillus Plantarumchickpea milkUHPLC/MSno


(2S,4S,5R,6R)-3,8,9-trioxatricyclo[4.2.1.02,4]nonan-5-ol

Compound Details

Synonymous names
2,3-Anhydro-d-mannosan
SCHEMBL9096793
RXDFVNWKKAAOSK-QTVWNMPRSA-N
Microorganism:

Yes

IUPAC name(2S,4S,5R,6R)-3,8,9-trioxatricyclo[4.2.1.02,4]nonan-5-ol
SMILESC1C2C(C3C(O3)C(O1)O2)O
InchiInChI=1S/C6H8O4/c7-3-2-1-8-6(9-2)5-4(3)10-5/h2-7H,1H2/t2-,3-,4+,5+,6?/m1/s1
FormulaC6H8O4
PubChem ID88413508
Molweight144.12
LogP-1.2
Atoms10
Bonds0
H-bond Acceptor4
H-bond Donor1
Chemical Classificationalcohols epoxides heterocyclic compounds ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


(E)-4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one

Compound Details

Synonymous names
beta-Ionone epoxide
23267-57-4
4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
(E)-4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
.beta.-Ionon-5,6-epoxide
5,6-Epoxy-beta-ionone
(5R,6S)-5,6-Epoxy-7-megastigmen-9-one
4-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-3-buten-2-one
.beta.-Ionone epoxide
beta-ionone 5,6-epoxide
Epoxy-.beta.-ionone
5,6-Epoxy-.beta.-ionone
.beta.-Ionone-5,6-epoxide
.beta.-Ionone-5,6-epoxyde
5,6-.beta.-Ionone epoxide
SCHEMBL1774698
CHEMBL3355912
SCHEMBL17627686
CHEBI:87546
CHEBI:208937
7-Oxabicyclo[4.1.0]heptane, 3-buten-2-one deriv.
(e)-4-(2,2,6-trimethyl-7-oxa-bicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
4-(1',2'-epoxy-2',6',6'-trimethyl-2'-cyclohex-1'-yl)-3-buten-2-one
(3E)-4-{2,2,6-TRIMETHYL-7-OXABICYCLO[4.1.0]HEPTAN-1-YL}BUT-3-EN-2-ONE
Microorganism:

Yes

IUPAC name(E)-4-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)but-3-en-2-one
SMILESCC(=O)C=CC12C(CCCC1(O2)C)(C)C
InchiInChI=1S/C13H20O2/c1-10(14)6-9-13-11(2,3)7-5-8-12(13,4)15-13/h6,9H,5,7-8H2,1-4H3/b9-6+
FormulaC13H20O2
PubChem ID5352481
Molweight208.3
LogP2
Atoms15
Bonds2
H-bond Acceptor2
H-bond Donor0
Chemical Classificationterpenes epoxides heterocyclic compounds ethers ketones
CHEBI-ID208937
Supernatural-IDSN0479774-01

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno


(1S,2R,5S,6R)-3-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol

Compound Details

Synonymous names
Theobroxide
(1S,2R,5S,6R)-3-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
Microorganism:

No

IUPAC name(1S,2R,5S,6R)-3-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
SMILESCC1=CC(C2C(C1O)O2)O
InchiInChI=1S/C7H10O3/c1-3-2-4(8)6-7(10-6)5(3)9/h2,4-9H,1H3/t4-,5+,6+,7-/m0/s1
FormulaC7H10O3
PubChem ID10898814
Molweight142.15
LogP-1.2
Atoms10
Bonds0
H-bond Acceptor3
H-bond Donor2
Chemical Classificationalcohols diols epoxides ethers heterocyclic compounds
Supernatural-IDSN0266029-01

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaLasiodiplodia Theobromaeisolate from disease coconuts in thirty districts of Tamil Nadu, indiaSudha et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaLasiodiplodia Theobromaepotato agar mediaSPME/GC-MSno