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Details of Hexacosanoic acid (1TMS)

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Role Analyte
nameHexacosanoic acid (1TMS)
MPIMP IDA304003
isotopomerambient
formulaC29H60O2Si
molecular mass468.872
monoisotopic mass468.43626
InChIInChI=1S/C29H60O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(30)31-32(2,3)4/h5-28H2,1-4H3
InChIKeyBHIAWJAQCOESNE-UHFFFAOYSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)3,036.31
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%273c585911-f640-4d51-b5a4-d746c30c7eef%27)

Synonyms of Hexacosanoic acid (1TMS)

propertyvalue
ChemSpider ID458647
PubChem CID526089
2 synonym(s)

Metabolite mapped to Hexacosanoic acid (1TMS)

Reference spectra of Hexacosanoic acid (1TMS)

replicaentry datedetectionmethodspecies
112/23/2003 12:00:00 AM M[2]Ovis aries
25/1/2001 12:00:00 AM M[EIGTMS]Standard
312/23/2003 12:00:00 AM M[2]Ovis aries
47/19/2007 11:16:30 AM MDN35Reference Substance
511/26/2004 12:00:00 AM M[FAME4090]Standard
67/19/2007 11:16:30 AM VAR5Reference Substance
712/23/2003 12:00:00 AM M[2]Ovis aries
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 Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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