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

 

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

replicalib entry datedetectionmethodspecies
728 August 2012  MassBank GC 2010 Tsujimoto 
630 March 2011  Fiehn_GC_2010 
503 November 2010  Schomburg_GC_2010 
119 July 2007 MS-TOFMDN35Reference Substance
312 May 2005  M[NIST] 
419 July 2007 MS-TOFVAR5Reference Substance
6 spectrum(a)
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Spectrum Details

analyteIsovaleric acid, 2-oxo- (1MEOX) (1TMS) MP
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
chromatogram4084EA26
citationBoelling C, Fiehn O (2005) Plant Physiol 139, 1995-2005
authorsBoelling C, Willmitzer L, 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)243.55
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)89
maximal intensity999
mass-intensity-peaks cardinality56 intensities
minimal m/z85
maximal m/z218
download JCAMP DXSpectrumJcampDx.ashx?id=45c3fafe-0355-4f2d-b792-65f531811858
download MSPSpectrumMsp.ashx?id=45c3fafe-0355-4f2d-b792-65f531811858

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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