Results for:
PubChem ID: 5365910

Methyl (2E)-3,7-dimethylocta-2,6-dienoate

Mass-Spectra

Compound Details

Synonymous names
Methyl geranate
1189-09-9
methyl (2E)-3,7-dimethylocta-2,6-dienoate
2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (E)-
Methyl (E)-geranate
2349-14-6
Methyl (E)-3,7-dimethylocta-2,6-dienoate
2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester
26YR95MGP2
Geranic acid methyl ester
2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (2E)-
E-Methylgeranate
methyl geraniate
Methyl 3,7-dimethyl-2,6-octadienoate
Methyl-trans-geranate
DTXSID4047129
UNII-26YR95MGP2
3,7-Dimethyl-2,6-octadienoic acid methyl ester
EINECS 214-712-6
Methyl trans-geranate
methyl-(E)-geranate
Methyl geranate, AldrichCPR
trans-Geranic acid methyl ester
DTXCID2027129
DTXSID40274147
CHEBI:166666
BAA18909
Tox21_302707
MFCD00036571
NCGC00256733-01
GERANIC ACID METHYL ESTER, TRANS-
CS-0453000
NS00080264
Q27254138
(2E)-3,7-dimethyl-octa-2,6-dienoic acid methyl ester
2,6-OCTADIENOIC ACID, 3,7-DIMETHYL-, METHYL ESTER, TRANS-
Microorganism:

Yes

IUPAC namemethyl (2E)-3,7-dimethylocta-2,6-dienoate
SMILESCC(=CCCC(=CC(=O)OC)C)C
InchiInChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8+
FormulaC11H18O2
PubChem ID5365910
Molweight182.26
LogP3.4
Atoms13
Bonds5
H-bond Acceptor2
H-bond Donor0
Chemical Classificationesters terpenes
CHEBI-ID166666
Supernatural-IDSN0001951-01

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaSalinispora Tropicanamarine sedimentGroenhagen et al. 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaSalinispora Tropicaseawater-based A1GC/MSno