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Adenosine, 5-methylthio- (3TMS)

 

Replica Mass Spectra of Adenosine, 5-methylthio- (3TMS)

replicalib entry datedetectionmethodspecies
1028 August 2012  MassBank GC 2010 Kusano 
1128 August 2012  MassBank GC 2010 Kusano 
617 March 2010 MS-TOFVAR5Solanum tuberosum
201 May 2001 MS-TOFM[EIGTMS]Reference Substance
717 March 2010 MS-TOFVAR5Brassica oleracea
1328 August 2012  MassBank GC 2010 Ara 
401 August 2002 MS-QuadM[2]Lotus japonicus (Regel) K. Larsen
930 March 2011  Fiehn_GC_2010 
501 May 2001 MS-TOFM[EIGTMS]Standard Addition
1228 August 2012  MassBank GC 2010 Tsujimoto 
10 spectrum(a)
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Spectrum Details

analyteAdenosine, 5-methylthio- (3TMS)
analyte InChIInChI=1S/C20H39N5O3SSi3/c1-29-11-14-16(27-31(5,6)7)17(28-32(8,9)10)20(26-14)25-13-23-15-18(24-30(2,3)4)21-12-22-19(15)25/h12-14,16-17,20H,11H2,1-10H3,(H,21,22,24)/t14?,16-,17-,20-/m1/s1
analyte mass513.88
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)40.91
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity1,000
mass-intensity-peaks cardinality274 intensities
minimal m/z45
maximal m/z515
download JCAMP DXSpectrumJcampDx.ashx?id=d0003771-4e25-456f-9e3b-8f3abb71746e
download MSPSpectrumMsp.ashx?id=d0003771-4e25-456f-9e3b-8f3abb71746e

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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