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Aconitic acid, trans- (3TMS)

 

Replica Mass Spectra of Aconitic acid, trans- (3TMS)

replicalib entry datedetectionmethodspecies
112 May 2005  M[NIST] 
426 March 2010 MS-TOFVAR5Reference Substance
530 March 2011  Fiehn_GC_2010 
312 May 2005  M[NIST] 
4 spectrum(a)
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Spectrum Details

analyteAconitic acid, trans- (3TMS)
analyte InChIInChI=1S/C15H30O6Si3/c1-22(2,3)19-13(16)10-12(15(18)21-24(7,8)9)11-14(17)20-23(4,5)6/h10H,11H2,1-9H3/b12-10+
analyte mass390.65
chromatogram4111ED25
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) 
base peak (m/z)147
maximal intensity999
mass-intensity-peaks cardinality120 intensities
minimal m/z85
maximal m/z377
download JCAMP DXSpectrumJcampDx.ashx?id=112c74a1-bacd-41c6-9440-cb5da83cc0dd
download MSPSpectrumMsp.ashx?id=112c74a1-bacd-41c6-9440-cb5da83cc0dd

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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