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Aspartic acid (4TMS)

 

Replica Mass Spectra of Aspartic acid (4TMS)

replicalib entry datedetectionmethodspecies
101 May 2001 MS-TOFM[EIGTMS]Standard
301 September 2001 MS-TOFM[EIGTMS]Saccharomyces cerevisiae
419 July 2007 MS-TOFVAR5Reference Substance
519 July 2007 MS-TOFMDN35Reference Substance
603 November 2010  Schomburg_GC_2010 
5 spectrum(a)
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Spectrum Details

analyteAspartic acid (4TMS)
analyte InChIInChI=1S/C16H39NO4Si4/c1-22(2,3)17(23(4,5)6)14(16(19)21-25(10,11)12)13-15(18)20-24(7,8)9/h14H,13H2,1-12H3/t14-/m1/s1
analyte mass421.83
chromatogramNA(_46)
citationStrelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
authorsStrelkov S, University of Cologne, CUBIC - Institute of Biochemistry, Department Prof. Schomburg, Zuelpicher Str. 47, D-50674 Cologne, Germany
lib entry date22 February 2005
metabolite roleMETB
retention time (sec)1,508.16
retention index (VAR5 method, n-alkanes C10–C36)1.727,51 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality83 intensities
minimal m/z42
maximal m/z445
download JCAMP DXSpectrumJcampDx.ashx?id=92a399ca-b3b9-43a2-b802-1ef0df5baf8a
download MSPSpectrumMsp.ashx?id=92a399ca-b3b9-43a2-b802-1ef0df5baf8a

GC-Method

nameM[STR]
citationStrelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
attributetextdetails
detectorMS-TOF 
ion sourceEI70eV
RIALKANEC10, C12, C15, C19, C22, C28, C32, C36
separationGCDB-5MS column (30m x 0.25µm) from J&W Scientific (Folsom, USA)

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