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Trehalose-6-phosphate (9TMS)

 

Replica Mass Spectra of Trehalose-6-phosphate (9TMS)

replicalib entry datedetectionmethodspecies
730 March 2011  Fiehn_GC_2010 
101 May 2001 MS-TOFM[EIGTMS]Saccharomyces cerevisiae
201 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
319 July 2007 MS-TOFMDN35Reference Substance
422 February 2005 MS-TOFM[STR] 
519 July 2007 MS-TOFVAR5Reference Substance
6 spectrum(a)
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Spectrum Details

analyteTrehalose-6-phosphate (9TMS)
analyte InChIInChI=1S/C39H95O14PSi9/c1-55(2,3)42-29-31-33(47-57(7,8)9)35(49-59(13,14)15)37(51-61(19,20)21)39(44-31)45-38-36(50-60(16,17)18)34(48-58(10,11)12)32(46-56(4,5)6)30(43-38)28-41-54(40,52-62(22,23)24)53-63(25,26)27/h30-39H,28-29H2,1-27H3
analyte mass1,071.91
chromatogram10300xx_01
citationNA
authorsJäger C, Schomburg D Department of Bioinformatics and Biochemistry, Technische Universität Carolo-Wilhelmina Braunschweig, Langer Kamp 19B, D-38106 Braunschweig, Germany
lib entry date03 November 2010
metabolite role 
retention time (sec)46.03
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)315
maximal intensity1,000
mass-intensity-peaks cardinality330 intensities
minimal m/z40
maximal m/z531
download JCAMP DXSpectrumJcampDx.ashx?id=3b98df12-9f10-4b0d-bd34-078a6eaa8168
download MSPSpectrumMsp.ashx?id=3b98df12-9f10-4b0d-bd34-078a6eaa8168

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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