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3-METHOXYCARBONYL-4-(2-CHLOROPHENYL)-1,4,5,6,7,8-HEXAHYDRO-2,7,7-TRIMETHYL-5-OXOQUINOLINE
SpectraBase Compound ID KubIf7e7ZxB
InChI InChI=1S/C20H22ClNO3/c1-11-16(19(24)25-4)17(12-7-5-6-8-13(12)21)18-14(22-11)9-20(2,3)10-15(18)23/h5-8,17,22H,9-10H2,1-4H3
InChIKey GVKGMJCOYFQOJF-UHFFFAOYSA-N
Mol Weight 359.85 g/mol
Molecular Formula C20H22ClNO3
Exact Mass 359.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dnvluMB1PC
Name Methyl 4-(2-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
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Formula C20H22ClNO3
InChI InChI=1S/C20H22ClNO3/c1-11-16(19(24)25-4)17(12-7-5-6-8-13(12)21)18-14(22-11)9-20(2,3)10-15(18)23/h5-8,17,22H,9-10H2,1-4H3
InChIKey GVKGMJCOYFQOJF-UHFFFAOYSA-N
Molecular Weight 359.853 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1c(cccc1)Cl)C(OC)=O)C
SPLASH splash10-000i-0920000000-a33c0a81b78571ae36d1
Source of Spectrum AOC-28-359/SM2-4b
Synonyms Methyl 4-(2-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate 4-(2-Chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Methyl 4-(2-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Methyl 4-(2-chlorophenyl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
Wiley ID 1768621