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4-(2-bromo-4,5-dimethoxy-phenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid sec-butyl ester
SpectraBase Compound ID 5Cq0rK7h7PC
InChI InChI=1S/C23H28BrNO5/c1-6-12(2)30-23(27)20-13(3)25-16-8-7-9-17(26)22(16)21(20)14-10-18(28-4)19(29-5)11-15(14)24/h10-12,21,25H,6-9H2,1-5H3
InChIKey SDIXCMQCDFABQU-UHFFFAOYSA-N
Mol Weight 478.38 g/mol
Molecular Formula C23H28BrNO5
Exact Mass 477.115086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7wT0AlKXHQg
Name 4-(2-bromo-4,5-dimethoxy-phenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid sec-butyl ester
Alternate Name(s) 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid butan-2-yl ester Butan-2-yl 4-(2-bromanyl-4,5-dimethoxy-phenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Butan-2-yl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate sec-butyl 4-(2-bromo-4,5-dimethoxy-phenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C23H28BrNO5
InChI InChI=1S/C23H28BrNO5/c1-6-12(2)30-23(27)20-13(3)25-16-8-7-9-17(26)22(16)21(20)14-10-18(28-4)19(29-5)11-15(14)24/h10-12,21,25H,6-9H2,1-5H3
InChIKey SDIXCMQCDFABQU-UHFFFAOYSA-N
Molecular Weight 478.383 g/mol
SMILES N1C(=C(C(C=2C(CCCC12)=O)c1c(cc(c(c1)OC)OC)Br)C(OC(CC)C)=O)C
SPLASH splash10-0a4j-5596000000-27db8b68ac86239b6b9a
Wiley ID 1458972