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Nicotinamide (1TMS)

 

Replica Mass Spectra of Nicotinamide (1TMS)

replicalib entry datedetectionmethodspecies
1330 March 2011  Fiehn_GC_2010 
119 July 2007 MS-TOFVAR5Reference Substance
1203 November 2010  Schomburg_GC_2010 
219 July 2007 MS-TOFVAR5Reference Substance
322 February 2005 MS-TOFM[STR] 
1728 August 2012  MassBank GC 2010 Ara 
519 July 2007 MS-TOFMDN35Reference Substance
1528 August 2012  MassBank GC 2010 Kusano 
626 November 2004  M[FAME4090]Standard
719 July 2007 MS-TOFMDN35Reference Substance
14 spectrum(a)
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Spectrum Details

analyteNicotinamide (1TMS)
analyte InChIInChI=1S/C9H14N2OSi/c1-13(2,3)11-9(12)8-5-4-6-10-7-8/h4-7H,1-3H3,(H,11,12)
analyte mass194.31
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)1,478.1 (predicted, according to Strehmel, N. et.al)
base peak (m/z)75
maximal intensity798,761
mass-intensity-peaks cardinality242 intensities
minimal m/z60
maximal m/z550
download JCAMP DXSpectrumJcampDx.ashx?id=a476eb8f-dd8e-4402-b424-9fdd30bdc166
download MSPSpectrumMsp.ashx?id=a476eb8f-dd8e-4402-b424-9fdd30bdc166

GC-Method

nameMRI_2013
citation 
no method details available

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