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Details of Tridecanoic acid

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Role Analyte
nameTridecanoic acid
MPIMP IDA176012
isotopomerambient
formulaC13H26O2
molecular mass214.345
monoisotopic mass286.23281
InChIInChI=1S/C16H34O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(17)18-19(2,3)4/h5-15H2,1-4H3
InChIKeyUZUTZCYXYDHJAT-UHFFFAOYSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,749.4
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27c62e3daf-461a-46f0-bf29-4cc56191f456%27)

Synonyms of Tridecanoic acid

propertyvalue
CAS169597-14-2
CAS638-53-9
ChemSpider ID453001
MAPMANTridecanoate
PubChem CID12530
PubChem CID519342
PubChem SID24899890
PubChem SID92297820
PubChem SID92297958
synonymTridecanoic acid
12 synonym(s)

Metabolite mapped to Tridecanoic acid

Reference spectra of Tridecanoic acid

replicaentry datedetectionmethodspecies
12/22/2005 12:00:00 AM M[STR] 
511/3/2010 4:23:36 PM Schomburg_GC_2010 
27/19/2007 11:16:30 AM VAR5Reference Substance
32/22/2005 12:00:00 AM M[STR] 
45/12/2005 12:00:00 AM M[NIST] 
5 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 10/1/2012 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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