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Mannitol (6TMS)

 

Replica Mass Spectra of Mannitol (6TMS)

replicalib entry datedetectionmethodspecies
2503 November 2010  Schomburg_GC_2010 
101 December 2003 MS-QuadM[2]Standard
212 May 2005  M[NIST] 
301 May 2001 MS-TOFM[EIGTMS]Standard Addition
401 July 2001 MS-QuadM[2]Standard
525 January 2005 MS-TOFM[MOR] 
701 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
812 May 2005  M[NIST] 
919 July 2007 MS-TOFVAR5Reference Substance
1019 July 2007 MS-TOFVAR5Reference Substance
25 spectrum(a)
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Spectrum Details

analyteMannitol (6TMS)
analyte InChIInChI=1S/C24H62O6Si6/c1-31(2,3)25-19-21(27-33(7,8)9)23(29-35(13,14)15)24(30-36(16,17)18)22(28-34(10,11)12)20-26-32(4,5)6/h21-24H,19-20H2,1-18H3/t21-,22-,23-,24-/m1/s1
analyte mass615.26
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) 
retention index (VAR5 method, n-alkanes C10–C36)1,916 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality213 intensities
minimal m/z39
maximal m/z524
download JCAMP DXSpectrumJcampDx.ashx?id=39165bac-1d25-4a3e-8461-5f51eaa74980
download MSPSpectrumMsp.ashx?id=39165bac-1d25-4a3e-8461-5f51eaa74980

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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