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Replica Mass Spectra of Cystathionine (4TMS)
replica | lib entry date | detection | method | species |
1 | 12 October 2005 | MS-TRAP | M[BAR] | |
13 | 28 August 2012 | | MassBank GC 2010 Ara | |
2 | 01 April 2002 | MS-Quad | M[2] | Standard |
3 | 22 February 2005 | MS-TOF | M[STR] | |
4 | 25 January 2005 | MS-TOF | M[MOR] | |
14 | 28 August 2012 | | MassBank GC 2010 Ara | |
5 | 19 July 2007 | MS-TOF | VAR5 | Reference Substance |
6 | 19 July 2007 | MS-TOF | MDN35 | Reference Substance |
12 | 28 August 2012 | | MassBank GC 2010 Tsujimoto | |
7 | 01 January 2002 | MS-TOF | M[EIGTMS] | Standard |
14 spectrum(a) |
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Spectrum Details
analyte | Cystathionine (4TMS) |
analyte InChI | InChI=1S/C19H46N2O4SSi4/c1-27(2,3)20-16(18(22)24-29(7,8)9)13-14-26-15-17(21-28(4,5)6)19(23)25-30(10,11)12/h16-17,20-21H,13-15H2,1-12H3/t16-,17?/m0/s1 |
analyte mass | 510.99 |
chromatogram | 10300xx_01 |
citation | NA |
authors | Jäger C, Schomburg D Department of Bioinformatics and Biochemistry, Technische Universität Carolo-Wilhelmina Braunschweig, Langer Kamp 19B, D-38106 Braunschweig, Germany |
lib entry date | 03 November 2010 |
metabolite role | |
retention time (sec) | 32.65 |
retention index (VAR5 method, n-alkanes C10–C36) | |
base peak (m/z) | 218 |
maximal intensity | 1,000 |
mass-intensity-peaks cardinality | 172 intensities |
minimal m/z | 42 |
maximal m/z | 512 |
download JCAMP DX | SpectrumJcampDx.ashx?id=3db63c87-d7c2-476d-8693-5c34db644e38 |
download MSP | SpectrumMsp.ashx?id=3db63c87-d7c2-476d-8693-5c34db644e38 |
GC-Method
name | Schomburg_GC_2010 |
citation | |
no method details available |
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