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Details of Pentadecanoic acid methyl ester, n-

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Role Analyte
namePentadecanoic acid methyl ester, n-
MPIMP IDA182011
isotopomerambient
formulaC16H32O2
molecular mass256.425
monoisotopic mass256.24023
InChIInChI=1S/C16H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h3-15H2,1-2H3
InChIKeyXIUXKAZJZFLLDQ-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O1
retention index (VAR5 method, n-alkanes C10–C36)1,824.66
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27512fe03e-2716-4499-a925-0701b34451b5%27)

Synonyms of Pentadecanoic acid methyl ester, n-

propertyvalue
CAS7132-64-1
ChemSpider ID21988
Method [J Kopka]Methylation
PubChem CID23518
PubChem SID92298151
synonymPentadecanoic acid methyl ester
synonymPentadecanoic acid methyl ester, n-
7 synonym(s)

Metabolite mapped to Pentadecanoic acid methyl ester, n-

Reference spectra of Pentadecanoic acid methyl ester, n-

replicaentry datedetectionmethodspecies
12/22/2005 12:00:00 AM M[STR] 
21/22/2005 12:00:00 AM M[ROE] 
711/3/2010 4:23:39 PM Schomburg_GC_2010 
39/7/2004 12:00:00 AM M[6]Standard Addition
42/22/2005 12:00:00 AM M[STR] 
55/12/2005 12:00:00 AM M[NIST] 
62/22/2005 12:00:00 AM M[STR] 
7 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 04/12/2020 © 2008-2014 Golm Metabolome Database - All rights reserved
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