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Norleucine (2TMS)

 

Replica Mass Spectra of Norleucine (2TMS)

replicalib entry datedetectionmethodspecies
1503 November 2010  Schomburg_GC_2010 
1828 August 2012  MassBank GC 2010 Tsujimoto 
119 July 2007 MS-TOFVAR5Reference Substance
201 November 2001 MS-TOFM[EIGTMS]Standard
1728 August 2012  MassBank GC 2010 Kusano 
401 November 2001 MS-QuadM[2]Standard
512 May 2005  M[NIST] 
622 February 2005 MS-TOFM[STR] 
712 May 2005  M[NIST] 
826 November 2004  M[FAME4090]Standard
20 spectrum(a)
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Spectrum Details

analyteNorleucine (2TMS)
analyte InChIInChI=1S/C12H29NO2Si2/c1-8-9-10-11(13-16(2,3)4)12(14)15-17(5,6)7/h11,13H,8-10H2,1-7H3
analyte mass275.54
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)1,030.2
retention index (VAR5 method, n-alkanes C10–C36)1,315.83 (predicted, according to Strehmel, N. et.al)
base peak (m/z)158
maximal intensity999
mass-intensity-peaks cardinality87 intensities
minimal m/z55
maximal m/z432
download JCAMP DXSpectrumJcampDx.ashx?id=153481ae-e910-43dc-b7b9-4edfe14fd91a
download MSPSpectrumMsp.ashx?id=153481ae-e910-43dc-b7b9-4edfe14fd91a

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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