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(S)-GAMMA-(2-METHYLSULFONYL-6-PROPYLPYRIMIDIN-4-YL)-ALPHA-AMINOBUTYRIC-ACID
SpectraBase Compound ID 17Vlzm2nQDd
InChI InChI=1S/C12H19N3O4S/c1-3-4-8-7-9(5-6-10(13)11(16)17)15-12(14-8)20(2,18)19/h7,10H,3-6,13H2,1-2H3,(H,16,17)/t10-/m1/s1
InChIKey BULPUHNULXDILT-SNVBAGLBSA-N
Mol Weight 301.36 g/mol
Molecular Formula C12H19N3O4S
Exact Mass 301.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oZwuiQTKjp
Name (S)-GAMMA-(2-METHYLSULFONYL-6-PROPYLPYRIMIDIN-4-YL)-ALPHA-AMINOBUTYRIC-ACID
Compound Number 54
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H19N3O4S
InChI InChI=1S/C12H19N3O4S/c1-3-4-8-7-9(5-6-10(13)11(16)17)15-12(14-8)20(2,18)19/h7,10H,3-6,13H2,1-2H3,(H,16,17)/t10-/m1/s1
InChIKey BULPUHNULXDILT-SNVBAGLBSA-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 301.361 g/mol
Solvent D2O
Source File Reference UWPA571