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Details of Salicylic acid (2TMS)

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Role Analyte
nameSalicylic acid (2TMS)
MPIMP IDA152003
isotopomerambient
formulaC13H22O3Si2
molecular mass282.483
monoisotopic mass282.11075
InChIInChI=1S/C13H22O3Si2/c1-17(2,3)15-12-10-8-7-9-11(12)13(14)16-18(4,5)6/h7-10H,1-6H3
InChIKeyBNAGIDDOEKUJRZ-UHFFFAOYSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,506.8
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%279fe00778-022e-4946-8b62-1ba1f4fde736%27)

Synonyms of Salicylic acid (2TMS)

propertyvalue
CAS3789-85-3
CAS69-72-7
ChemSpider ID454330
PubChem CID520871
synonymAcetylsalicylic acid
synonymBenzoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
synonymSA TMS 1
synonymSalicylic acid
synonymsalicylic acid (TMS)
synonymSALICYLIC ACID 2TMS
11 synonym(s)

Metabolite mapped to Salicylic acid (2TMS)

Reference spectra of Salicylic acid (2TMS)

replicaentry datedetectionmethodspecies
2511/3/2010 4:22:47 PM Schomburg_GC_2010 
111/29/2003 12:00:00 AM M[2]Standard
212/1/2003 12:00:00 AM M[2]Standard
32/1/2002 12:00:00 AM M[2]Standard
55/12/2005 12:00:00 AM M[NIST] 
76/1/2001 12:00:00 AM M[EIGTMS]Alyssum lesbiacum
99/11/2005 12:00:00 AM M[FAME4090]Standard
109/16/2004 12:00:00 AM M[2]Reference Substance
112/1/2005 12:00:00 AM M[6]Reference Substance
125/12/2005 12:00:00 AM M[NIST] 
23 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 03/01/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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