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N-[(1S)-(Carboxymethyl)-2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2,3-didehydro-3-ethyl-4-oxopiperidine
SpectraBase Compound ID FFtTi6vzQGn
InChI InChI=1S/C19H24BrNO5/c1-5-12-11-21(7-6-16(12)22)15(19(23)26-4)8-13-9-17(24-2)18(25-3)10-14(13)20/h9-11,15H,5-8H2,1-4H3/t15-/m0/s1
InChIKey LFXCEJFQUGAPKK-HNNXBMFYSA-N
Mol Weight 426.31 g/mol
Molecular Formula C19H24BrNO5
Exact Mass 425.083786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oNsd45PJ8o
Name N-[(1S)-(Carboxymethyl)-2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2,3-didehydro-3-ethyl-4-oxopiperidine
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Formula C19H24BrNO5
InChI InChI=1S/C19H24BrNO5/c1-5-12-11-21(7-6-16(12)22)15(19(23)26-4)8-13-9-17(24-2)18(25-3)10-14(13)20/h9-11,15H,5-8H2,1-4H3/t15-/m0/s1
InChIKey LFXCEJFQUGAPKK-HNNXBMFYSA-N
Molecular Weight 426.307 g/mol
SMILES C=1N(CCC(C1CC)=O)[C@@](Cc1c(cc(c(c1)OC)OC)Br)(C(=O)OC)[H]
SPLASH splash10-0002-9430100000-23863f4e9782b31c5745
Source of Spectrum J-63-4944-22
Synonyms (6-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-5-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridinyl)acetic acid (S)-3-(2-Bromo-4,5-dimethoxy-phenyl)-2-(5-ethyl-4-oxo-3,4-dihydro-2H-pyridin-1-yl)-propionic acid methyl ester (2S)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(5-ethyl-4-oxo-2,3-dihydropyridin-1-yl)propanoic acid methyl ester Methyl (2S)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(5-ethyl-4-oxo-2,3-dihydropyridin-1-yl)propanoate Methyl (2S)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-(5-ethyl-4-oxo-2,3-dihydropyridin-1-yl)propanoate Methyl (2S)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(5-ethyl-4-oxidanylidene-2,3-dihydropyridin-1-yl)propanoate
Wiley ID 1379602