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Dodecanoic acid methyl ester (FAME MIX)

 

Replica Mass Spectra of Dodecanoic acid methyl ester (FAME MIX)

replicalib entry datedetectionmethodspecies
1305 June 2013  MRI_2013 
608 October 2009 MS-TOFVAR5Reference Substance
1223 July 2012 MS-TOFVAR5 
1130 March 2011  Fiehn_GC_2010 
808 October 2009 MS-TOFVAR5Reference Substance
908 October 2009 MS-TOFVAR5Reference Substance
322 February 2005 MS-TOFM[STR] 
508 October 2009 MS-TOFVAR5Reference Substance
1003 November 2010  Schomburg_GC_2010 
708 October 2009 MS-TOFVAR5Reference Substance
11 spectrum(a)
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Spectrum Details

analyteDodecanoic acid methyl ester (FAME MIX)
analyte InChIInChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3
analyte mass214.34
chromatogramNA(_26)
citationStrelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
authorsStrelkov S, University of Cologne, CUBIC - Institute of Biochemistry, Department Prof. Schomburg, Zuelpicher Str. 47, D-50674 Cologne, Germany
lib entry date22 February 2005
metabolite roleMETB
retention time (sec)1,343.52
retention index (VAR5 method, n-alkanes C10–C36)1.516,46 (predicted, according to Strehmel, N. et.al)
base peak (m/z)74
maximal intensity999
mass-intensity-peaks cardinality55 intensities
minimal m/z39
maximal m/z214
download JCAMP DXSpectrumJcampDx.ashx?id=f993e5fd-575d-495f-9306-44f136eeb6b8
download MSPSpectrumMsp.ashx?id=f993e5fd-575d-495f-9306-44f136eeb6b8

GC-Method

nameM[STR]
citationStrelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
attributetextdetails
detectorMS-TOF 
ion sourceEI70eV
RIALKANEC10, C12, C15, C19, C22, C28, C32, C36
separationGCDB-5MS column (30m x 0.25µm) from J&W Scientific (Folsom, USA)

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