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(S)-N-(ETHOXYCARBONYL)-[1,2,3-(13)C(3)]-2-AMINO-1-PHENYLPROPAN-1-ONE
SpectraBase Compound ID JeP5qZZUySq
InChI InChI=1S/C12H15NO3/c1-3-16-12(15)13-9(2)11(14)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)
InChIKey KMFWBYWPQAVFAM-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6E7260YomQ
Name (S)-N-(ETHOXYCARBONYL)-[1,2,3-(13)C(3)]-2-AMINO-1-PHENYLPROPAN-1-ONE
Compound Number [1,2,3-(13)C(3)]-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-3-16-12(15)13-9(2)11(14)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)
InChIKey KMFWBYWPQAVFAM-UHFFFAOYSA-N
Literature Reference Author G.GRUE-SORENSEN,I.D.SPENSER
Literature Reference Citation J.AM.CHEM.SOC.,116,6195(1994)
Literature Reference DOI 10.1021/ja00093a019
Molecular Weight 221.256 g/mol
Solvent D2O
Source File Reference UWRU10877