GOLM METABOLOME DATABASE
How would you rate the quality of this mass spectrum?
poor, not helpful 
 outstanding, most helpful.
This spectrum was 0 times rated; on average=0.0

Butanoic acid, 3-hydroxy- (2TMS)

 

Replica Mass Spectra of Butanoic acid, 3-hydroxy- (2TMS)

replicalib entry datedetectionmethodspecies
112 May 2005  M[NIST] 
212 May 2005  M[NIST] 
319 July 2007 MS-TOFVAR5Reference Substance
603 November 2010  Schomburg_GC_2010 
512 May 2005  M[NIST] 
728 August 2012  MassBank GC 2010 Kusano 
828 August 2012  MassBank GC 2010 Tsujimoto 
7 spectrum(a)
rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Spectrum Details

analyteButanoic acid, 3-hydroxy- (2TMS)
analyte InChIInChI=1S/C10H24O3Si2/c1-9(12-14(2,3)4)8-10(11)13-15(5,6)7/h9H,8H2,1-7H3/t9-/m1/s1
analyte mass248.47
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)1,147.8 (predicted, according to Strehmel, N. et.al)
base peak (m/z)147
maximal intensity572,151
mass-intensity-peaks cardinality246 intensities
minimal m/z60
maximal m/z549
download JCAMP DXSpectrumJcampDx.ashx?id=81931d4d-05a4-4486-bb8b-45d306b57996
download MSPSpectrumMsp.ashx?id=81931d4d-05a4-4486-bb8b-45d306b57996

GC-Method

nameMRI_2013
citation 
no method details available

comments on this mass spectrum

Post a Comment
Name:
 
Website:
Email:
Comments:
service last updated 31/08/2021 © 2008-2014 Golm Metabolome Database - All rights reserved
Top