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Details of Sebacic acid (2TMS)

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Role Analyte
nameSebacic acid (2TMS)
MPIMP IDA189018
isotopomerambient
formulaC16H34O4Si2
molecular mass346.610
monoisotopic mass346.19956
InChIInChI=1S/C16H34O4Si2/c1-21(2,3)19-15(17)13-11-9-7-8-10-12-14-16(18)20-22(4,5)6/h7-14H2,1-6H3
InChIKeyBDACUOPQFMCPLO-UHFFFAOYSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,885.64
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27e2078ff4-499a-4600-9697-85e70bb9aa19%27)

Synonyms of Sebacic acid (2TMS)

propertyvalue
ChemSpider ID453198
1 synonym(s)

Metabolite mapped to Sebacic acid (2TMS)

Reference spectra of Sebacic acid (2TMS)

replicaentry datedetectionmethodspecies
78/28/2012 5:51:49 PM MassBank GC 2010 Ara 
11/25/2005 12:00:00 AM M[MOR] 
25/12/2005 12:00:00 AM M[NIST] 
86/5/2013 12:39:00 PM MRI_2013 
38/23/2005 12:00:00 AM M[FAME4090] 
58/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
68/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
45/12/2005 12:00:00 AM M[NIST] 
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 Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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