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Isovaleric acid, 2-oxo- (1MEOX) (1TMS) BP

 

Replica Mass Spectra of Isovaleric acid, 2-oxo- (1MEOX) (1TMS) BP

replicalib entry datedetectionmethodspecies
528 August 2012  MassBank GC 2010 Tsujimoto 
430 March 2011  Fiehn_GC_2010 
126 November 2004  M[FAME4090]Standard
219 July 2007 MS-TOFVAR5Reference Substance
4 spectrum(a)
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Spectrum Details

analyteIsovaleric acid, 2-oxo- (1MEOX) (1TMS) BP
analyte InChIInChI=1S/C9H19NO3Si/c1-7(2)8(10-12-3)9(11)13-14(4,5)6/h7H,1-6H3/b10-8-
analyte mass217.34
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)11.94
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality102 intensities
minimal m/z45
maximal m/z281
download JCAMP DXSpectrumJcampDx.ashx?id=64f9a382-c222-4817-a3c5-c6285d9893c2
download MSPSpectrumMsp.ashx?id=64f9a382-c222-4817-a3c5-c6285d9893c2

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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