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Gluconic acid-6-phosphate (7TMS)

 

Replica Mass Spectra of Gluconic acid-6-phosphate (7TMS)

replicalib entry datedetectionmethodspecies
101 January 2002 MS-TOFM[EIGTMS]Reference Substance
212 May 2005  M[NIST] 
1403 November 2010  Schomburg_GC_2010 
512 May 2005  M[NIST] 
612 May 2005  M[NIST] 
712 October 2005 MS-TRAPM[BAR] 
822 February 2005 MS-TOFM[STR] 
1001 November 2001 MS-QuadM[2]Reference Substance
1101 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
1530 March 2011  Fiehn_GC_2010 
12 spectrum(a)
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Spectrum Details

analyteGluconic acid-6-phosphate (7TMS)
analyte InChIInChI=1S/C27H69O10PSi7/c1-39(2,3)31-23(22-30-38(29,36-44(16,17)18)37-45(19,20)21)24(32-40(4,5)6)25(33-41(7,8)9)26(34-42(10,11)12)27(28)35-43(13,14)15/h23-26H,22H2,1-21H3/t23-,24-,25+,26-/m1/s1
analyte mass781.4
chromatogram4083EA36
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 roleMETB
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)2,414.04 (predicted, according to Strehmel, N. et.al)
base peak (m/z)147
maximal intensity999
mass-intensity-peaks cardinality293 intensities
minimal m/z85
maximal m/z473
download JCAMP DXSpectrumJcampDx.ashx?id=795203d0-2dab-4245-9ef2-385de5626d0a
download MSPSpectrumMsp.ashx?id=795203d0-2dab-4245-9ef2-385de5626d0a

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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