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Gluconic acid-1,5-lactone (4TMS)

 

Replica Mass Spectra of Gluconic acid-1,5-lactone (4TMS)

replicalib entry datedetectionmethodspecies
125 January 2005 MS-TOFM[MOR] 
226 November 2004  M[FAME4090]Standard
1330 March 2011  Fiehn_GC_2010 
1428 August 2012  MassBank GC 2010 Tsujimoto 
322 February 2005 MS-TOFM[STR] 
1605 June 2013  MRI_2013 
1528 August 2012  MassBank GC 2010 Tsujimoto 
415 March 2005 MS-TOFM[6]Reference Substance
519 July 2007 MS-TOFVAR5Reference Substance
601 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
14 spectrum(a)
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Spectrum Details

analyteGluconic acid-1,5-lactone (4TMS)
analyte InChIInChI=1S/C18H42O6Si4/c1-25(2,3)20-13-14-15(22-26(4,5)6)16(23-27(7,8)9)17(18(19)21-14)24-28(10,11)12/h14-17H,13H2,1-12H3/t14-,15-,16+,17-/m1/s1
analyte mass466.86
chromatogram10300xx_01
citationNA
authorsJäger C, Schomburg D Department of Bioinformatics and Biochemistry, Technische Universität Carolo-Wilhelmina Braunschweig, Langer Kamp 19B, D-38106 Braunschweig, Germany
lib entry date03 November 2010
metabolite role 
retention time (sec)27.84
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity1,000
mass-intensity-peaks cardinality183 intensities
minimal m/z45
maximal m/z467
download JCAMP DXSpectrumJcampDx.ashx?id=798e202e-e1b8-4c52-af2f-7b5abd806d7a
download MSPSpectrumMsp.ashx?id=798e202e-e1b8-4c52-af2f-7b5abd806d7a

GC-Method

nameSchomburg_GC_2010
citation 
no method details available

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