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2-Methyl-4-(5-methyl-2-thiophenyl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
SpectraBase Compound ID 3sxjAwiRBhI
InChI InChI=1S/C21H21NO3S2/c1-11-6-7-17(27-11)20-18(21(24)25-3)12(2)22-14-9-13(10-15(23)19(14)20)16-5-4-8-26-16/h4-8,13,20,22H,9-10H2,1-3H3
InChIKey LCKHTSLEPQBFHG-UHFFFAOYSA-N
Mol Weight 399.52 g/mol
Molecular Formula C21H21NO3S2
Exact Mass 399.096286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dHlN6a7Dr0
Name 2-Methyl-4-(5-methyl-2-thiophenyl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester
Alternate Name(s) 5-keto-2-methyl-4-(5-methyl-2-thienyl)-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid methyl ester Methyl 2-methyl-4-(5-methyl-2-thienyl)-5-oxo-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C21H21NO3S2
InChI InChI=1S/C21H21NO3S2/c1-11-6-7-17(27-11)20-18(21(24)25-3)12(2)22-14-9-13(10-15(23)19(14)20)16-5-4-8-26-16/h4-8,13,20,22H,9-10H2,1-3H3
InChIKey LCKHTSLEPQBFHG-UHFFFAOYSA-N
Molecular Weight 399.523 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)c1sccc1)=O)c1sc(C)cc1)C(=O)OC)C
SPLASH splash10-0f6w-6947000000-10018a6cb65ecd8b1ba1
Wiley ID 1455283