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cyano-L-alanine, 2TMS
SpectraBase Compound ID 4yxep7TnMML
InChI InChI=1S/C10H22N2O2Si2/c1-15(2,3)12-9(7-8-11)10(13)14-16(4,5)6/h9,12H,7H2,1-6H3
InChIKey BIWYGTLVKZLKSV-UHFFFAOYSA-N
Mol Weight 258.47 g/mol
Molecular Formula C10H22N2O2Si2
Exact Mass 258.121981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtdJjWiOg9
Name cyano-L-alanine, 2TMS
Comments Derivatization type: 2 TMS (mass: 258.122); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000125; Note: The molecular formula of the structure shown is C4H6N2O2 - which differs from the formula reported for the mass spectrum (C10H22N2O2Si2)
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Formula C10H22N2O2Si2
InChI InChI=1S/C10H22N2O2Si2/c1-15(2,3)12-9(7-8-11)10(13)14-16(4,5)6/h9,12H,7H2,1-6H3
InChIKey BIWYGTLVKZLKSV-UHFFFAOYSA-N
Molecular Weight 258.468 g/mol
SMILES N(C(CC#N)C(=O)O[Si](C)(C)C)[Si](C)(C)C
SPLASH splash10-0006-1900000000-2bd8dfcf7dae226de347
Source of Spectrum FM-2019-125-0
Synonyms 3-Cyanoalanine, 2TMS beta-Cyanoalanine, 2TMS beta-Cyanolalanine, 2TMS .beta.-Cyanoalanine, 2TMS BCNA, 2TMS .beta.-Cyanolalanine, 2TMS 2-Amino-3-cyanopropanoic acid, 2TMS Trimethylsilyl 3-cyano-2-((trimethylsilyl)amino)propanoate
Wiley ID 1817819