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3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-[4-(4-morpholinylmethyl)-2-thienyl]-5-oxo-, ethyl ester
SpectraBase Compound ID CGVh0anyecb
InChI InChI=1S/C22H28N2O4S/c1-3-28-22(26)19-14(2)23-16-5-4-6-17(25)20(16)21(19)18-11-15(13-29-18)12-24-7-9-27-10-8-24/h11,13,21,23H,3-10,12H2,1-2H3
InChIKey JLTJFPDWYMIQJX-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C22H28N2O4S
Exact Mass 416.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9S5znQWq7zT
Name 3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-[4-(4-morpholinylmethyl)-2-thienyl]-5-oxo-, ethyl ester
Alternate Name(s) 2-Methyl-4-[4-(4-morpholinylmethyl)-2-thiophenyl]-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Ethyl 2-methyl-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Ethyl 2-methyl-4-[4-(morpholinomethyl)-2-thienyl]-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Ethyl 2-methyl-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C22H28N2O4S
InChI InChI=1S/C22H28N2O4S/c1-3-28-22(26)19-14(2)23-16-5-4-6-17(25)20(16)21(19)18-11-15(13-29-18)12-24-7-9-27-10-8-24/h11,13,21,23H,3-10,12H2,1-2H3
InChIKey JLTJFPDWYMIQJX-UHFFFAOYSA-N
Molecular Weight 416.536 g/mol
SMILES N1C2=C(C(C(=C1C)C(=O)OCC)c1scc(c1)CN1CCOCC1)C(CCC2)=O
SPLASH splash10-001i-7594000000-62a4f6e06b2780e1a8e7
Source of Spectrum IY-1-4540-0
Wiley ID 1653383