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(S)-BETA-(2-METHYLTHIOPYRIMIDIN-4-YL)-ALPHA-AMINOPROPANOIC-ACID
SpectraBase Compound ID KHExFZnnWD2
InChI InChI=1S/C8H11N3O2S/c1-14-8-10-3-2-5(11-8)4-6(9)7(12)13/h2-3,6H,4,9H2,1H3,(H,12,13)/t6-/m1/s1
InChIKey GRFRLBPIABADAZ-ZCFIWIBFSA-N
Mol Weight 213.25 g/mol
Molecular Formula C8H11N3O2S
Exact Mass 213.057198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9sVZi7OER7J
Name (S)-BETA-(2-METHYLTHIOPYRIMIDIN-4-YL)-ALPHA-AMINOPROPANOIC-ACID
Compound Number 52
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11N3O2S
InChI InChI=1S/C8H11N3O2S/c1-14-8-10-3-2-5(11-8)4-6(9)7(12)13/h2-3,6H,4,9H2,1H3,(H,12,13)/t6-/m1/s1
InChIKey GRFRLBPIABADAZ-ZCFIWIBFSA-N
Literature Reference Author R.M.ADLINGTON,J.E.BALDWIN,D.CATTERICK,G.J.PRITCHARD
Literature Reference Citation J.CHEM.SOC.PERKIN-1,855(1999)
Literature Reference DOI 10.1039/a806741d
Molecular Weight 213.254 g/mol
Solvent D2O
Source File Reference UWPA569