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Details of Cystine (4TMS)

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Role Analyte
nameCystine (4TMS)
MPIMP IDA241002
isotopomerambient
formulaC18H44N2O4S2Si4
molecular mass529.028
monoisotopic mass528.18196
InChIInChI=1S/C18H44N2O4S2Si4/c1-27(2,3)19-15(17(21)23-29(7,8)9)13-25-26-14-16(20-28(4,5)6)18(22)24-30(10,11)12/h15-16,19-20H,13-14H2,1-12H3/t15-,16?/m0/s1
InChIKeyQLOSYBGVFCKXGZ-VYRBHSGPSA-N
substructure TMS4
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,290.87
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27715f4a0d-fbb3-4cb4-9d24-3d55bcd29e7b%27)

Synonyms of Cystine (4TMS)

propertyvalue
ChemSpider ID461826
PubChem CID530163
2 synonym(s)

Metabolite mapped to Cystine (4TMS)

metabolitestereoisomerisotopomer
CystineL- ambient
CystineDL- ambient
2 metabolite(s)

Reference spectra of Cystine (4TMS)

replicaentry datedetectionmethodspecies
208/28/2012 5:51:49 PM MassBank GC 2010 Ara 
218/28/2012 5:51:49 PM MassBank GC 2010 Ara 
21/25/2005 12:00:00 AM M[MOR] 
55/12/2005 12:00:00 AM M[NIST] 
65/12/2005 12:00:00 AM M[NIST] 
72/1/2005 12:00:00 AM M[6]Reference Substance
811/26/2004 12:00:00 AM M[FAME4090]Standard
246/5/2013 12:39:00 PM MRI_2013 
168/28/2012 5:51:49 PM MassBank GC 2010 Kusano 
188/28/2012 5:51:49 PM MassBank GC 2010 Tsujimoto 
17 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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