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Details of Homovanillic acid (2TMS)

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Role Analyte
nameHomovanillic acid (2TMS)
MPIMP IDA177018
isotopomerambient
formulaC15H26O4Si2
molecular mass326.536
monoisotopic mass326.13696
InChIInChI=1S/C15H26O4Si2/c1-17-14-10-12(11-15(16)19-21(5,6)7)8-9-13(14)18-20(2,3)4/h8-10H,11H2,1-7H3
InChIKeyPPAQHWGGSXMRBE-UHFFFAOYSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,770.97
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2713f8edcc-4a20-4af4-870d-ec4642e669e6%27)

Synonyms of Homovanillic acid (2TMS)

propertyvalue
ChemSpider ID481325
PubChem CID553440
synonymB000557
synonymHomovanillic acid (2TMS)
4 synonym(s)

Metabolite mapped to Homovanillic acid (2TMS)

Reference spectra of Homovanillic acid (2TMS)

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
58/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
27/19/2007 11:16:30 AM MDN35Reference Substance
37/19/2007 11:16:30 AM VAR5Reference Substance
66/5/2013 12:39:00 PM MRI_2013 
47/19/2007 11:16:30 AM MDN35Reference Substance
6 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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