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Suberic acid (2TMS)

 

Replica Mass Spectra of Suberic acid (2TMS)

replicalib entry datedetectionmethodspecies
112 May 2005  M[NIST] 
212 May 2005  M[NIST] 
312 May 2005  M[NIST] 
928 August 2012  MassBank GC 2010 Tsujimoto 
401 May 2001 MS-TOFM[EIGTMS]Arabidopsis thaliana
509 December 2003 MS-QuadM[2]Standard
601 February 2005 MS-TOFM[6]Reference Substance
712 May 2005  M[NIST] 
819 July 2007 MS-TOFVAR5Reference Substance
9 spectrum(a)
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Spectrum Details

analyteSuberic acid (2TMS)
analyte InChIInChI=1S/C14H30O4Si2/c1-19(2,3)17-13(15)11-9-7-8-10-12-14(16)18-20(4,5)6/h7-12H2,1-6H3
analyte mass318.56
chromatogram10300xx_41
citationNA
authorsKopka J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date05 June 2013
metabolite role 
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1,696.96 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity1,490,895
mass-intensity-peaks cardinality326 intensities
minimal m/z60
maximal m/z546
download JCAMP DXSpectrumJcampDx.ashx?id=28736e17-83d0-426e-82f9-3f59f576e064
download MSPSpectrumMsp.ashx?id=28736e17-83d0-426e-82f9-3f59f576e064

GC-Method

nameMRI_2013
citation 
no method details available

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