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Proline, 4-hydroxy-, trans- (2TMS)

 

Replica Mass Spectra of Proline, 4-hydroxy-, trans- (2TMS)

replicalib entry datedetectionmethodspecies
403 November 2010  Schomburg_GC_2010 
505 June 2013  MRI_2013 
212 May 2005  M[NIST] 
319 July 2007 MS-TOFVAR5Reference Substance
4 spectrum(a)
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Spectrum Details

analyteProline, 4-hydroxy-, trans- (2TMS)
analyte InChIInChI=1S/C11H25NO3Si2/c1-16(2,3)14-9-7-10(12-8-9)11(13)15-17(4,5)6/h9-10,12H,7-8H2,1-6H3/t9-,10+/m1/s1
analyte mass275.49
chromatogramNA(_49)
citation 
authorsRoessner-Tunali U, Forbes MG, University of Melbourne, School of Botany, 3010 Victoria, Australia
lib entry date19 January 2005
metabolite roleMETB
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1.470,03 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity999
mass-intensity-peaks cardinality103 intensities
minimal m/z70
maximal m/z594
download JCAMP DXSpectrumJcampDx.ashx?id=807afe70-1878-4127-b2fe-90679bc1775c
download MSPSpectrumMsp.ashx?id=807afe70-1878-4127-b2fe-90679bc1775c

GC-Method

nameM[ROE]
citationU. Roessner, J. Patterson, M. Forbes, G. Fincher, P. Langridge, A. Bacic, Plant Physiology 142 (2006) 1087
attributetextdetails
deconvolutionXcalibur program 
derivatizationMEOX; MSTFAMETHOXYAMINATION: 120min at 37°C; SILYLATION: 30min at 37°C
detectorMS-QUADm/z = 70-600; scans:2/s; DSQ quadrupole mass spectrometer
extractionmethanol:chloroform 
ion sourceEI70eV
RIALKANEC12, C15, C19, C22, C28, C32, C36
separationGCCOLUMN:5%diphenyl-95%dimethylpolysiloxane, 30+10m, ID:0.25mm, DF:0.25µm, VF-5MS (Varian, Darmstadt, Germany); PROGRAM:injection at 70°C, ramp 1°C/min to 76°C, ramp 6°C/min to 330°C, iso at 330°C for 10min; FLOW:Helium, 1mL/min; INJECTION:1µL, splitless, 230°C; TRANSFER:280°C; IONSOURCE:250°C

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