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Inositol, allo- (6TMS)

 

Replica Mass Spectra of Inositol, allo- (6TMS)

replicalib entry datedetectionmethodspecies
101 August 2002 MS-QuadM[2]Lotus japonicus (Regel) K. Larsen
630 March 2011  Fiehn_GC_2010 
219 July 2007 MS-TOFVAR5Reference Substance
312 May 2005  M[NIST] 
519 July 2007 MS-TOFMDN35Reference Substance
5 spectrum(a)
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Spectrum Details

analyteInositol, allo- (6TMS)
analyte InChIInChI=1S/C24H60O6Si6/c1-31(2,3)25-19-20(26-32(4,5)6)22(28-34(10,11)12)24(30-36(16,17)18)23(29-35(13,14)15)21(19)27-33(7,8)9/h19-24H,1-18H3/t19-,20-,21-,22-,23-,24+
analyte mass613.24
chromatogram4117ED51
citation 
authorsFiehn O, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date26 November 2004
metabolite roleMST
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1,882.64 (predicted, according to Strehmel, N. et.al)
base peak (m/z)147
maximal intensity999
mass-intensity-peaks cardinality193 intensities
minimal m/z85
maximal m/z509
download JCAMP DXSpectrumJcampDx.ashx?id=6ff9ddb9-ded3-4427-9932-c76aabcf3995
download MSPSpectrumMsp.ashx?id=6ff9ddb9-ded3-4427-9932-c76aabcf3995

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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