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(2S)-3-amino-2-benzyl-3-keto-2-methyl-propionic acid ethyl ester
SpectraBase Compound ID Ev6whThCsNl
InChI InChI=1S/C13H17NO3/c1-3-17-12(16)13(2,11(14)15)9-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,14,15)/t13-/m0/s1
InChIKey SSNDAPTVMBVCOR-ZDUSSCGKSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bcBRzC90EM
Name (2S)-3-amino-2-benzyl-3-keto-2-methyl-propionic acid ethyl ester
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Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-3-17-12(16)13(2,11(14)15)9-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,14,15)/t13-/m0/s1
InChIKey SSNDAPTVMBVCOR-ZDUSSCGKSA-N
Molecular Weight 235.283 g/mol
SMILES NC([C@@](C(=O)OCC)(Cc1ccccc1)C)=O
SPLASH splash10-0006-9310000000-f487d5815b39ddec4a69
Source of Spectrum KD-14-2141-7
Synonyms (2S)-3-amino-2-methyl-3-oxo-2-(phenylmethyl)propanoic acid ethyl ester Ethyl (2S)-3-amino-2-benzyl-2-methyl-3-oxo-propanoate Ethyl (2S)-3-azanyl-2-methyl-3-oxidanylidene-2-(phenylmethyl)propanoate
Wiley ID 1636131