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Glycine (3TMS)

 

Replica Mass Spectra of Glycine (3TMS)

replicalib entry datedetectionmethodspecies
101 August 2002 MS-QuadM[2]Lotus japonicus (Regel) K. Larsen
3928 August 2012  MassBank GC 2010 Kusano 
212 June 2003 MS-QuadM[2]Arabidopsis thaliana
323 December 2003 MS-QuadM[2]Ovis aries
419 January 2005 MS-QUADM[ROE] 
512 May 2005  M[NIST] 
601 August 2001 MS-QuadM[2]Standard
811 September 2005  M[FAME4090]Standard
901 June 2001 MS-TOFM[EIGTMS]Reference Substance
1011 September 2005  M[FAME4090]Standard
38 spectrum(a)
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Spectrum Details

analyteGlycine (3TMS)
analyte InChIInChI=1S/C11H29NO2Si3/c1-15(2,3)12(16(4,5)6)10-11(13)14-17(7,8)9/h10H2,1-9H3
analyte mass291.61
chromatogramNA(_27)
citationBarsch A, Patschkowski T, Niehaus K (2004) Funct Integrat Genomics 4, 219-230
authorsBarsch A, Puehse M, Persicke M, Bielefeld University, Department of Molecular Phytopathology (Prof. Niehaus K), D-33501 Bielefeld, Germany
lib entry date12 October 2005
metabolite roleMETB
retention time (sec)1,009.8
retention index (VAR5 method, n-alkanes C10–C36)1.304,11 (predicted, according to Strehmel, N. et.al)
base peak (m/z)174
maximal intensity999
mass-intensity-peaks cardinality93 intensities
minimal m/z50
maximal m/z501
download JCAMP DXSpectrumJcampDx.ashx?id=7be6f246-6c11-4df7-a939-25ece08aa321
download MSPSpectrumMsp.ashx?id=7be6f246-6c11-4df7-a939-25ece08aa321

GC-Method

nameM[BAR]
citationBarsch A, Patschkowski T, Niehaus K (2004) Funct Integrat Genomics 4, 219-230
attributetextdetails
deconvolutionAMDIS, National Institute of Standards and Technology, Gaithersburg, MD, USA 
derivatizationMEOX; TMSMethoxyamination:90min37°C; Trimethylsilylation:30min37°C
detectorMS-TRAPMZ:50-550; SCANS:2/s; PolarisQ; Thermo-Finnigan, Dreieich, Germany
extractionmethanol:water (4:1; v/v); 70°C 
ion sourceEI70eV
metabolic inactivationfiltration; liquid nitrogen; lyophilization 
partitioningnone 
RIALKANEC12, C15, C18, C19, C22, C28, C32, C36
separationGCCOLUMN:5%diphenyl-95%dimethylpolysiloxane, 30m, ID:0.25mm, DF:0.25microm, EQUITY-5, #NA (Supelco, Bellfonte, CA, USA); PROGRAM:iso3min80°C, ramp3°C/min, iso1min300°C; FLOW:Helium, 0.6ml/min; INJECTION:1microL, splitless, 250°C; TRANSFER:250°C; IONSOURCE:200°C

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