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Butanoic acid, 4-[(4-methoxyphenyl)amino]-4-oxo-, 1-methyl-2-oxo-2-phenylethyl ester
SpectraBase Compound ID G30gqAq2Pwq
InChI InChI=1S/C20H21NO5/c1-14(20(24)15-6-4-3-5-7-15)26-19(23)13-12-18(22)21-16-8-10-17(25-2)11-9-16/h3-11,14H,12-13H2,1-2H3,(H,21,22)
InChIKey BDMDDUPLDURMJD-UHFFFAOYSA-N
Mol Weight 355.39 g/mol
Molecular Formula C20H21NO5
Exact Mass 355.141973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zAikx1h0xv
Name Butanoic acid, 4-[(4-methoxyphenyl)amino]-4-oxo-, 1-methyl-2-oxo-2-phenylethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 355.141972775 u
Formula C20H21NO5
InChI InChI=1S/C20H21NO5/c1-14(20(24)15-6-4-3-5-7-15)26-19(23)13-12-18(22)21-16-8-10-17(25-2)11-9-16/h3-11,14H,12-13H2,1-2H3,(H,21,22)
InChIKey BDMDDUPLDURMJD-UHFFFAOYSA-N
Molecular Weight 355.390 g/mol
SMILES N(C(CCC(OC(C(=O)C=1C=CC=CC1)C)=O)=O)C1=CC=C(C=C1)OC