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

Phenylalanine (1TMS)

 

Replica Mass Spectra of Phenylalanine (1TMS)

replicalib entry datedetectionmethodspecies
1030 March 2011  Fiehn_GC_2010 
903 November 2010  Schomburg_GC_2010 
222 February 2005 MS-TOFM[STR] 
312 May 2005  M[NIST] 
415 March 2005 MS-TOFM[6]Reference Substance
501 November 2001 MS-TOFM[EIGTMS]Corynebacterium glutamicum
1130 March 2011  Fiehn_GC_2010 
622 February 2005 MS-TOFM[STR] 
719 July 2007 MS-TOFVAR5Reference Substance
1205 June 2013  MRI_2013 
11 spectrum(a)
rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Spectrum Details

analytePhenylalanine (1TMS)
analyte InChIInChI=1S/C12H19NO2Si/c1-16(2,3)15-12(14)11(13)9-10-7-5-4-6-8-10/h4-8,11H,9,13H2,1-3H3/t11-/m0/s1
analyte mass237.37
chromatogram1164EK04
citationWagner C, Sefkow M, Kopka J (2003) Phytochemistry 62, 887-900
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 date01 May 2001
metabolite roleMETB
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1.554,1 (predicted, according to Strehmel, N. et.al)
base peak (m/z)120
maximal intensity999
mass-intensity-peaks cardinality67 intensities
minimal m/z70
maximal m/z519
download JCAMP DXSpectrumJcampDx.ashx?id=4f0080f3-0afa-4d75-a120-271cd646ccaa
download MSPSpectrumMsp.ashx?id=4f0080f3-0afa-4d75-a120-271cd646ccaa

GC-Method

nameM[EIGTMS]
citationWagner C, Sefkow M, Kopka J (2003) Phytochemistry 62, 887-900
attributetextdetails
deconvolutionAMDIS, National Institute of Standards and Technology, Gaithersburg, MD, USADIRECTION:non scanning; WIDTH: 20; SUBTRACTION: two; RESOLUTION: high; SENSITIVITY: medium; SHAPE: high
derivatizationMEOX; TMSMethoxyamination:60min37°C; Trimethylsilylation:>60min37°C
detectorMS-TOFMZ:70-600; SCANS:6/s; Pegasus II 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, C19, C22, C28, C32, C36
separationGCCOLUMN:5%diphenyl-95%dimethylpolysiloxane (arylene), 30+10m, ID:0.25mm, DF:0.25microm, Rtx-5SilMS Integra-Guard, #NA (Restek, Bad Homburg, Germany); PROGRAM:iso2min80°C, ramp15°C/min, iso2min350°C; FLOW:Helium, 1.0ml/min; INJECTION:1microL, splitless, 230°C, 2min110psi; TRANSFER:250°C; IONSOURCE:200°C

comments on this mass spectrum

Post a Comment
Name:
 
Website:  
Email:
Comments:
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
Top