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Cystathionine (4TMS)

 

Replica Mass Spectra of Cystathionine (4TMS)

replicalib entry datedetectionmethodspecies
112 October 2005 MS-TRAPM[BAR] 
1328 August 2012  MassBank GC 2010 Ara 
201 April 2002 MS-QuadM[2]Standard
322 February 2005 MS-TOFM[STR] 
425 January 2005 MS-TOFM[MOR] 
1428 August 2012  MassBank GC 2010 Ara 
519 July 2007 MS-TOFVAR5Reference Substance
619 July 2007 MS-TOFMDN35Reference Substance
1228 August 2012  MassBank GC 2010 Tsujimoto 
701 January 2002 MS-TOFM[EIGTMS]Standard
14 spectrum(a)
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Spectrum Details

analyteCystathionine (4TMS)
analyte InChIInChI=1S/C19H46N2O4SSi4/c1-27(2,3)20-16(18(22)24-29(7,8)9)13-14-26-15-17(21-28(4,5)6)19(23)25-30(10,11)12/h16-17,20-21H,13-15H2,1-12H3/t16-,17?/m0/s1
analyte mass510.99
chromatogram10300xx_01
citationNA
authorsJäger C, Schomburg D Department of Bioinformatics and Biochemistry, Technische Universität Carolo-Wilhelmina Braunschweig, Langer Kamp 19B, D-38106 Braunschweig, Germany
lib entry date03 November 2010
metabolite role 
retention time (sec)32.65
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)218
maximal intensity1,000
mass-intensity-peaks cardinality172 intensities
minimal m/z42
maximal m/z512
download JCAMP DXSpectrumJcampDx.ashx?id=3db63c87-d7c2-476d-8693-5c34db644e38
download MSPSpectrumMsp.ashx?id=3db63c87-d7c2-476d-8693-5c34db644e38

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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