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myo-Inositol-1-phosphate (7TMS)

 

Replica Mass Spectra of myo-Inositol-1-phosphate (7TMS)

replicalib entry datedetectionmethodspecies
101 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
222 January 2005 MS-QUADM[ROE] 
312 May 2005  M[NIST] 
401 October 2001 MS-TOFM[EIGTMS]Saccharomyces cerevisiae
601 May 2001 MS-TOFM[EIGTMS]Standard Addition
812 October 2005 MS-TRAPM[BAR] 
901 November 2001 MS-QuadM[2]Standard
1012 May 2005  M[NIST] 
8 spectrum(a)
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Spectrum Details

analytemyo-Inositol-1-phosphate (7TMS)
analyte InChIInChI=1S/C27H69O9PSi7/c1-38(2,3)30-23-22(29-37(28,35-43(16,17)18)36-44(19,20)21)24(31-39(4,5)6)26(33-41(10,11)12)27(34-42(13,14)15)25(23)32-40(7,8)9/h22-27H,1-21H3/t22-,23-,24-,25+,26-,27-/m1/s1
analyte mass765.4
chromatogram51631
citation 
authorsSchauer N, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date11 September 2005
metabolite roleMETB
retention time (sec)776.38
retention index (VAR5 method, n-alkanes C10–C36)2,414.29 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality434 intensities
minimal m/z70
maximal m/z600
download JCAMP DXSpectrumJcampDx.ashx?id=8e77cecc-d488-41fc-83da-ac0bebc1f1c9
download MSPSpectrumMsp.ashx?id=8e77cecc-d488-41fc-83da-ac0bebc1f1c9

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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