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Details of Heptadecanoic acid methyl ester, n-

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Role Analyte
nameHeptadecanoic acid methyl ester, n-
MPIMP IDA203008
isotopomerambient
formulaC18H36O2
molecular mass284.478
monoisotopic mass284.27153
InChIInChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3
InChIKeyHUEBIMLTDXKIPR-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O1
retention index (VAR5 method, n-alkanes C10–C36)2,030.68
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27c3327dcb-292a-4a14-b668-4b598d19d2f1%27)

Synonyms of Heptadecanoic acid methyl ester, n-

propertyvalue
CAS1731-92-6
ChemSpider ID14849
Method [J Kopka]Methylation
PubChem CID15609
PubChem SID92298028
synonymHeptadecanoic acid methyl ester
synonymHeptadecanoic acid methyl ester, n-
synonymMargaric acid methyl ester
8 synonym(s)

Metabolite mapped to Heptadecanoic acid methyl ester, n-

Reference spectra of Heptadecanoic acid methyl ester, n-

replicaentry datedetectionmethodspecies
711/3/2010 4:23:34 PM Schomburg_GC_2010 
19/7/2004 12:00:00 AM M[6]Standard Addition
25/1/2003 12:00:00 AM M[2]Spathodea campanulata P. Beauv.
32/22/2005 12:00:00 AM M[STR] 
42/22/2005 12:00:00 AM M[STR] 
55/12/2005 12:00:00 AM M[NIST] 
83/30/2011 4:52:37 PM Fiehn_GC_2010 
61/22/2005 12:00:00 AM M[ROE] 
8 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 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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