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Pyrophosphate (4TMS)

 

Replica Mass Spectra of Pyrophosphate (4TMS)

replicalib entry datedetectionmethodspecies
212 May 2005  M[NIST] 
1330 March 2011  Fiehn_GC_2010 
501 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
601 September 2001 MS-TOFM[EIGTMS]Saccharomyces cerevisiae
722 February 2005 MS-TOFM[STR] 
812 May 2005  M[NIST] 
1122 February 2005 MS-TOFM[STR] 
7 spectrum(a)
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Spectrum Details

analytePyrophosphate (4TMS)
analyte InChIInChI=1S/C12H36O7P2Si4/c1-22(2,3)16-20(13,17-23(4,5)6)15-21(14,18-24(7,8)9)19-25(10,11)12/h1-12H3
analyte mass466.7
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)23.22
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)451
maximal intensity1,000
mass-intensity-peaks cardinality165 intensities
minimal m/z45
maximal m/z470
download JCAMP DXSpectrumJcampDx.ashx?id=b9752657-2ae0-43a2-aa92-532757da878c
download MSPSpectrumMsp.ashx?id=b9752657-2ae0-43a2-aa92-532757da878c

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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