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4-(4-carbomethoxyphenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid phenethyl ester
SpectraBase Compound ID ENwredefp5g
InChI InChI=1S/C29H31NO5/c1-18-24(28(33)35-15-14-19-8-6-5-7-9-19)25(20-10-12-21(13-11-20)27(32)34-4)26-22(30-18)16-29(2,3)17-23(26)31/h5-13,25,30H,14-17H2,1-4H3
InChIKey QQIRWVKTIDGUHJ-UHFFFAOYSA-N
Mol Weight 473.57 g/mol
Molecular Formula C29H31NO5
Exact Mass 473.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MXaIfMbkl4
Name 4-(4-carbomethoxyphenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid phenethyl ester
Alternate Name(s) phenethyl 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate 4-(4-Methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-phenylethyl ester 2-Phenylethyl 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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Formula C29H31NO5
InChI InChI=1S/C29H31NO5/c1-18-24(28(33)35-15-14-19-8-6-5-7-9-19)25(20-10-12-21(13-11-20)27(32)34-4)26-22(30-18)16-29(2,3)17-23(26)31/h5-13,25,30H,14-17H2,1-4H3
InChIKey QQIRWVKTIDGUHJ-UHFFFAOYSA-N
Molecular Weight 473.569 g/mol
SMILES N1C2=C(C(C(=C1C)C(=O)OCCc1ccccc1)c1ccc(C(=O)OC)cc1)C(CC(C2)(C)C)=O
SPLASH splash10-000i-3958100000-903979a7a414866ea5ce
Wiley ID 1460607