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Details of Adenine (2TMS)

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Role Analyte
nameAdenine (2TMS)
MPIMP IDA188005
isotopomerambient
formulaC11H21N5Si2
molecular mass279.489
monoisotopic mass279.13355
InChIInChI=1S/C11H21N5Si2/c1-17(2,3)15-11-9-10(12-7-13-11)14-8-16(9)18(4,5)6/h7-8H,1-6H3,(H,12,13,15)
InChIKeyWFUAURRCBBWRBU-UHFFFAOYSA-N
substructure TMS2
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,873.97
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%276f8c37fc-0787-4264-9d5f-31c5ea2543c6%27)

Synonyms of Adenine (2TMS)

propertyvalue
ChemSpider ID540414
PubChem CID87396
2 synonym(s)

Metabolite mapped to Adenine (2TMS)

metabolitestereoisomerisotopomer
Adenineno ambient
1 metabolite(s)

Reference spectra of Adenine (2TMS)

replicaentry datedetectionmethodspecies
12/1/2005 12:00:00 AM M[6]Reference Substance
208/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
211/26/2004 12:00:00 AM M[FAME4090]Standard
236/5/2013 12:39:00 PM MRI_2013 
32/22/2005 12:00:00 AM M[STR] 
42/22/2005 12:00:00 AM M[STR] 
62/1/2005 12:00:00 AM M[6]Reference Substance
711/1/2001 12:00:00 AM M[EIGTMS]Standard
811/1/2001 12:00:00 AM M[2]Standard
92/1/2005 12:00:00 AM M[6]Reference Substance
21 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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