GOLM METABOLOME DATABASE

Details of Decanoic acid, methyl ester (FAME MIX)

rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol
Role Analyte
nameDecanoic acid, methyl ester (FAME MIX)
MPIMP IDA133007
isotopomerambient
formulaC11H22O2
molecular mass186.292
monoisotopic mass186.16198
InChIInChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3
InChIKeyYRHYCMZPEVDGFQ-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O1
retention index (VAR5 method, n-alkanes C10–C36)1,326.87
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27bb30d0e8-dd7e-4a77-9781-4c29389b3f24%27)

Synonyms of Decanoic acid, methyl ester (FAME MIX)

propertyvalue
BRENDA49372
CAS110-42-9
ChemSpider ID7759
Method [J Kopka]Methylation
PubChem CID8050
PubChem SID92297817
synonymC10acidMeO
synonymDecanoic acid, methyl ester
synonymDecanoic acid, methyl ester, n-
9 synonym(s)

Metabolite mapped to Decanoic acid, methyl ester (FAME MIX)

Reference spectra of Decanoic acid, methyl ester (FAME MIX)

replicaentry datedetectionmethodspecies
710/8/2009 2:19:32 PM VAR5Reference Substance
93/19/2010 9:06:35 AM VAR5Arabidopsis Thaliana
15/12/2005 12:00:00 AM M[NIST] 
22/22/2005 12:00:00 AM M[STR] 
810/8/2009 2:31:39 PM VAR5Reference Substance
510/8/2009 1:51:10 PM VAR5Reference Substance
32/22/2005 12:00:00 AM M[STR] 
610/8/2009 2:06:13 PM VAR5Reference Substance
410/8/2009 1:37:48 PM VAR5Reference Substance
113/30/2011 4:52:37 PM Fiehn_GC_2010 
13 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 5/21/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Kopka J., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
Top