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Dodecanoic acid (1TMS)

 

Replica Mass Spectra of Dodecanoic acid (1TMS)

replicalib entry datedetectionmethodspecies
207 September 2004 MS-TOFM[6]Standard Addition
301 May 2001 MS-TOFM[EIGTMS]Standard Addition
512 May 2005  M[NIST] 
601 May 2003 MS-QuadM[2]Spathodea campanulata P. Beauv.
725 January 2005 MS-TOFM[MOR] 
819 July 2007 MS-TOFVAR5Reference Substance
901 May 2001 MS-TOFM[EIGTMS]Solanum tuberosum
1012 May 2005  M[NIST] 
1430 March 2011  Fiehn_GC_2010 
1528 August 2012  MassBank GC 2010 Tsujimoto 
13 spectrum(a)
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Spectrum Details

analyteDodecanoic acid (1TMS)
analyte InChIInChI=1S/C15H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-15(16)17-18(2,3)4/h5-14H2,1-4H3
analyte mass272.5
chromatogram4111ED06
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 roleCONT-METB
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1.653,95 (predicted, according to Strehmel, N. et.al)
base peak (m/z)117
maximal intensity999
mass-intensity-peaks cardinality92 intensities
minimal m/z85
maximal m/z272
download JCAMP DXSpectrumJcampDx.ashx?id=a2fe4e85-ac1b-4b88-aa5a-00957ae74a11
download MSPSpectrumMsp.ashx?id=a2fe4e85-ac1b-4b88-aa5a-00957ae74a11

GC-Method

nameM[FAME4090]
citation 
attributetextdetails
ion sourceEI 

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