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Maltitol (9TMS)

 

Replica Mass Spectra of Maltitol (9TMS)

replicalib entry datedetectionmethodspecies
111 September 2005  M[FAME4090]Standard
201 July 2001 MS-QuadM[2]Standard
311 September 2005  M[FAME4090]Standard
930 March 2011  Fiehn_GC_2010 
401 October 2001 MS-TOFM[EIGTMS]Standard
525 January 2005 MS-TOFM[MOR] 
626 November 2004  M[FAME4090]Standard
701 February 2005 MS-TOFM[6]Reference Substance
819 July 2007 MS-TOFVAR5Reference Substance
9 spectrum(a)
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Spectrum Details

analyteMaltitol (9TMS)
analyte InChIInChI=1S/C39H96O11Si9/c1-51(2,3)40-28-31-35(47-56(16,17)18)37(49-58(22,23)24)38(50-59(25,26)27)39(43-31)44-34(32(45-54(10,11)12)29-41-52(4,5)6)36(48-57(19,20)21)33(46-55(13,14)15)30-42-53(7,8)9/h31-39H,28-30H2,1-27H3/t31-,32-,33+,34-,35-,36-,37+,38-,39-/m1/s1
analyte mass993.94
chromatogram10300xx_41
citationNA
authorsKopka J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date05 June 2013
metabolite role 
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)2.824,14 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity583.357
mass-intensity-peaks cardinality411 intensities
minimal m/z60
maximal m/z549
download JCAMP DXSpectrumJcampDx.ashx?id=41318fa1-604e-4e3a-955f-f1f48718dea2
download MSPSpectrumMsp.ashx?id=41318fa1-604e-4e3a-955f-f1f48718dea2

GC-Method

nameMRI_2013
citation 
no method details available

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