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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-[3-(phenylmethoxy)phenyl]-, methyl ester
SpectraBase Compound ID rRN6bSqCQ
InChI InChI=1S/C27H29NO4/c1-17-23(26(30)31-4)24(25-21(28-17)14-27(2,3)15-22(25)29)19-11-8-12-20(13-19)32-16-18-9-6-5-7-10-18/h5-13,24,28H,14-16H2,1-4H3
InChIKey YGGFGMYIPDTDLB-UHFFFAOYSA-N
Mol Weight 431.53 g/mol
Molecular Formula C27H29NO4
Exact Mass 431.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcGtPS3rh6z
Name 2,7,7-trimethyl-5-oxo-4-(3-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester
Alternate Name(s) 4-(3-benzoxyphenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Methyl 2,7,7-trimethyl-5-oxidanylidene-4-(3-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Methyl 2,7,7-trimethyl-5-oxo-4-(3-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Methyl 4-(3-benzyloxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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Formula C27H29NO4
InChI InChI=1S/C27H29NO4/c1-17-23(26(30)31-4)24(25-21(28-17)14-27(2,3)15-22(25)29)19-11-8-12-20(13-19)32-16-18-9-6-5-7-10-18/h5-13,24,28H,14-16H2,1-4H3
InChIKey YGGFGMYIPDTDLB-UHFFFAOYSA-N
Molecular Weight 431.532 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1cc(OCc2ccccc2)ccc1)C(=O)OC)C
SPLASH splash10-0002-3190000000-c7e1b39e66c9354468b5
Wiley ID 1453671