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

Glycerol-3-phosphate (4TMS)


Replica Mass Spectra of Glycerol-3-phosphate (4TMS)

replicalib entry datedetectionmethodspecies
2928 August 2012  MassBank GC 2010 Ara 
2828 August 2012  MassBank GC 2010 Kusano 
201 November 2001 MS-QuadM[2]Standard
301 December 2003 MS-QuadM[2]Arabidopsis thaliana
401 November 2001 MS-TOFM[EIGTMS]Standard
512 May 2005  M[NIST] 
2603 November 2010  Schomburg_GC_2010 
601 October 2001 MS-TOFM[EIGTMS]Standard Addition
719 January 2005 MS-QUADM[ROE] 
2730 March 2011  Fiehn_GC_2010 
26 spectrum(a)
rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Spectrum Details

analyteGlycerol-3-phosphate (4TMS)
analyte InChIInChI=1S/C15H41O6PSi4/c1-23(2,3)18-14-15(19-24(4,5)6)13-17-22(16,20-25(7,8)9)21-26(10,11)12/h15H,13-14H2,1-12H3/t15-/m0/s1
analyte mass460.8
authorsLiebig F, Erban A, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date01 February 2005
metabolite roleMETB
retention time (sec)1,092.43
retention index (VAR5 method, n-alkanes C10–C36)1.749,85 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality186 intensities
minimal m/z70
maximal m/z448
download JCAMP DXSpectrumJcampDx.ashx?id=97abc8b8-f401-4512-83e6-596f3178275f
download MSPSpectrumMsp.ashx?id=97abc8b8-f401-4512-83e6-596f3178275f


citationErban A, Schauer N, Fernie AR, Kopka J (2006) In: Weckwerth W (ed): Methods in Molecular Biology Vol., Humana Press Inc., Totowa, USA
deconvolutionChromaTOF V1.00 (Pegasus Driver 1.61), LECO, St. Joseph, MI, USAOFFSET:1_SMOOTHING:3_WIDTH:6_SN:>2
derivatizationMEOX; TMSMethoxyamination:90min40°C; Trimethylsilylation:45min40°C
detectorMS-TOFMZ:70-600; SCANS:20/s; Pegasus III TOF-MS; LECO, St. Joseph, MI, USA
extractionmethanol:water (4:1; v/v); 15min70°C 
ion sourceEI70eV
metabolic inactivationcut; liquid nitrogen; -80°C 
partitioningmethanol fraction of a methanol:water:chloroform (approx. 2:2:1, v/v/v) partitioning 
RIALKANEC12, C15, C18, C19, C22, C28, C32, C36
separationGCCOLUMN:5%diphenyl-95%dimethylpolysiloxane (arylene), 30+10m, ID:0.25mm, DF:0.25microm, Rtx-5SilMS Integra-Guard, #525560 (Restek, Bad Homburg, Germany); PROGRAM:iso1min70°C, ramp9°C/min, iso5min350°C; FLOW:Helium, 0.6ml/min; INJECTION:1microL, splitless, 230°C; TRANSFER:250°C; IONSOURCE:250°C

comments on this mass spectrum

Post a Comment
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved