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Phosphoenolpyruvic acid (3TMS)

 

Replica Mass Spectra of Phosphoenolpyruvic acid (3TMS)

replicalib entry datedetectionmethodspecies
122 February 2005 MS-TOFM[STR] 
222 February 2005 MS-TOFM[STR] 
828 August 2012  MassBank GC 2010 Tsujimoto 
319 July 2007 MS-TOFMDN35Reference Substance
603 November 2010  Schomburg_GC_2010 
730 March 2011  Fiehn_GC_2010 
419 July 2007 MS-TOFVAR5Reference Substance
7 spectrum(a)
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Spectrum Details

analytePhosphoenolpyruvic acid (3TMS)
analyte InChIInChI=1S/C12H29O6PSi3/c1-11(12(13)16-20(2,3)4)15-19(14,17-21(5,6)7)18-22(8,9)10/h1H2,2-10H3
analyte mass384.59
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)1.599,47 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity416.944
mass-intensity-peaks cardinality346 intensities
minimal m/z60
maximal m/z547
download JCAMP DXSpectrumJcampDx.ashx?id=d49d5d90-2552-4c4b-a2d1-10e955ad11ad
download MSPSpectrumMsp.ashx?id=d49d5d90-2552-4c4b-a2d1-10e955ad11ad

GC-Method

nameMRI_2013
citation 
no method details available

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