Results for:
PubChem ID: 7824

Methyl Hexanoate

Mass-Spectra

Compound Details

Synonymous names
NUKZAGXMHTUAFE-UHFFFAOYSA-N
METHYL HEXANOATE
Methyl caproate
Methyl capronate
Methyl hexylate
formyl hexanoate
Methyl hexoate
Hexanoic acid methyl
Methyl hexanoate, analytical standard
Methyl n-hexanoate
Methyl n-hexoate
HEXANOIC ACID,METHYL ESTER
Caproic acid methyl ester
Hexanoic Acid Methyl Ester
AC1L1PMU
Hexanoic acid, methylester
Methyl ester of hexanoic acid
Caproic acid, methyl ester
Hexanoic acid, methyl ester
n-Caproic acid methyl ester
Methyl caproate (natural)
KSC492A9F
NSC5023
7798AF
CTK3J2092
Methyl hexanoate, 99%
S0304
ACMC-209t5u
SCHEMBL124681
246364VPJS
Methyl hexanoate, certified reference material, TraceCERT(R)
LP066479
LS-2932
DTXSID0047616
STL453686
SBB060591
OR037678
Methyl caproate, United States Pharmacopeia (USP) Reference Standard
Jsp000597
NSC-5023
NSC 5023
CHEBI:77322
A801486
UNII-246364VPJS
ZINC1680660
AN-22444
ANW-42064
CJ-06272
LMFA07010433
MFCD00009510
ZINC01680660
Methyl hexanoate, >=99%, FG
TR-001335
RTR-001335
ST51046742
AKOS000121260
I14-2601
J-001632
BRN 1744683
FEMA No. 2708
FT-0628711
Methyl hexanoate, natural, >=99%, FG
106-70-7
MCULE-2317616388
EINECS 203-425-1
METHYL CAPROATE, 99.5% (GLC)
WE(1:0/6:0)
MolPort-003-927-919
338DD8BE-299B-44EE-816C-16C9BDD20EC6
InChI=1/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H
Microorganism:

Yes

IUPAC namemethyl hexanoate
SMILESCCCCCC(=O)OC
InchiInChI=1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
FormulaC7H14O2
PubChem ID7824
Molweight130.187
LogP1.96
Atoms23
Bonds22
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationEster esters

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaLactobacillus Rhamnosus CIRM1436naDomiati cheesePogačić et al., 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaCollimonas Pratensis Ter91Headspace trapping/GC-MS
BacteriaLactobacillus Rhamnosus CIRM1436curd-based broth mediumGC/MSYes