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Spermidine (5TMS)

 

Replica Mass Spectra of Spermidine (5TMS)

replicalib entry datedetectionmethodspecies
215 March 2005 MS-TOFM[6]Reference Substance
401 November 2001 MS-TOFM[EIGTMS]Reference Substance
501 February 2005 MS-TOFM[6]Reference Substance
625 January 2005 MS-TOFM[MOR] 
811 September 2005  M[FAME4090]Standard
2028 August 2012  MassBank GC 2010 Ara 
1928 August 2012  MassBank GC 2010 Tsujimoto 
901 September 2001 MS-QuadM[2]Standard
1011 September 2005  M[FAME4090]Standard
1101 February 2005 MS-TOFM[6]Reference Substance
18 spectrum(a)
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Spectrum Details

analyteSpermidine (5TMS)
analyte InChIInChI=1S/C22H59N3Si5/c1-26(2,3)23(20-18-22-25(29(10,11)12)30(13,14)15)19-16-17-21-24(27(4,5)6)28(7,8)9/h16-22H2,1-15H3
analyte mass506.15
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)2,261.4
retention index (VAR5 method, n-alkanes C10–C36)2.252,66 (predicted, according to Strehmel, N. et.al)
base peak (m/z)144
maximal intensity999
mass-intensity-peaks cardinality146 intensities
minimal m/z56
maximal m/z542
download JCAMP DXSpectrumJcampDx.ashx?id=31664d03-1c23-4d5f-aa46-0d2040092d1a
download MSPSpectrumMsp.ashx?id=31664d03-1c23-4d5f-aa46-0d2040092d1a

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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