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Arabitol (5TMS)

 

Replica Mass Spectra of Arabitol (5TMS)

replicalib entry datedetectionmethodspecies
1405 June 2013  MRI_2013 
114 November 2003 MS-QuadM[2]Arabidopsis thaliana
223 December 2003 MS-QuadM[2]Ovis aries
312 May 2005  M[NIST] 
425 January 2005 MS-TOFM[MOR] 
526 November 2004  M[FAME4090]Standard
1003 November 2010  Schomburg_GC_2010 
1130 March 2011  Fiehn_GC_2010 
1228 August 2012  MassBank GC 2010 Tsujimoto 
1328 August 2012  MassBank GC 2010 Ara 
13 spectrum(a)
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Spectrum Details

analyteArabitol (5TMS)
analyte InChIInChI=1S/C20H52O5Si5/c1-26(2,3)21-16-18(23-28(7,8)9)20(25-30(13,14)15)19(24-29(10,11)12)17-22-27(4,5)6/h18-20H,16-17H2,1-15H3/t18-,19-/m1/s1
analyte mass513.05
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)1,495.02
retention index (VAR5 method, n-alkanes C10–C36)1.709,09 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality23 intensities
minimal m/z73
maximal m/z319
download JCAMP DXSpectrumJcampDx.ashx?id=ef1a32a0-575b-4ec1-9fa2-8fd83a917236
download MSPSpectrumMsp.ashx?id=ef1a32a0-575b-4ec1-9fa2-8fd83a917236

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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