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Methyl (2'R,2R/S)-2-Benzyl-3-oxo-2-[1-(2-pyridinyl)ethyl]-2-butenoate
SpectraBase Compound ID ClwKS1NW5CK
InChI InChI=1S/C19H21NO3/c1-14(17-11-7-8-12-20-17)19(15(2)21,18(22)23-3)13-16-9-5-4-6-10-16/h4-12,14H,13H2,1-3H3/t14-,19?/m0/s1
InChIKey FDSNQYZWHPHJJV-KTQQKIMGSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVeoDesL5Ql
Name Methyl (2'R,2R/S)-2-Benzyl-3-oxo-2-[1-(2-pyridinyl)ethyl]-2-butenoate
Alternate Name(s) (3R)-2-acetyl-2-(phenylmethyl)-3-(2-pyridinyl)butanoic acid methyl ester Methyl (3R)-2-acetyl-2-benzyl-3-pyridin-2-ylbutanoate Methyl (3R)-2-acetyl-2-benzyl-3-(2-pyridyl)butanoate Methyl (3R)-2-ethanoyl-2-(phenylmethyl)-3-pyridin-2-yl-butanoate
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Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-14(17-11-7-8-12-20-17)19(15(2)21,18(22)23-3)13-16-9-5-4-6-10-16/h4-12,14H,13H2,1-3H3/t14-,19?/m0/s1
InChIKey FDSNQYZWHPHJJV-KTQQKIMGSA-N
Molecular Weight 311.381 g/mol
SMILES C(C(=O)OC)([C@](c1ncccc1)(C)[H])(C(=O)C)Cc1ccccc1
SPLASH splash10-0a4i-0920000000-5d308917279d26e4fe32
Source of Spectrum E2-50-699-7
Wiley ID 1555813