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4-(4-acetoxyphenyl)-5-keto-2-methyl-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid tetrahydrofurfuryl ester
SpectraBase Compound ID H0tuWtRm2D8
InChI InChI=1S/C28H29NO6S/c1-16-25(28(32)34-15-21-5-3-11-33-21)26(18-7-9-20(10-8-18)35-17(2)30)27-22(29-16)13-19(14-23(27)31)24-6-4-12-36-24/h4,6-10,12,19,21,26,29H,3,5,11,13-15H2,1-2H3
InChIKey HKBLEGXWTKSSFK-UHFFFAOYSA-N
Mol Weight 507.6 g/mol
Molecular Formula C28H29NO6S
Exact Mass 507.171559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hia1bHJWTWA
Name 4-(4-acetoxyphenyl)-5-keto-2-methyl-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid tetrahydrofurfuryl ester
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Formula C28H29NO6S
InChI InChI=1S/C28H29NO6S/c1-16-25(28(32)34-15-21-5-3-11-33-21)26(18-7-9-20(10-8-18)35-17(2)30)27-22(29-16)13-19(14-23(27)31)24-6-4-12-36-24/h4,6-10,12,19,21,26,29H,3,5,11,13-15H2,1-2H3
InChIKey HKBLEGXWTKSSFK-UHFFFAOYSA-N
Molecular Weight 507.601 g/mol
SMILES N1C2=C(C(C(=C1C)C(OCC1OCCC1)=O)c1ccc(OC(=O)C)cc1)C(CC(C2)c1sccc1)=O
SPLASH splash10-006x-9212000000-d5ce602ff3a89df43c05
Synonyms 4-(4-acetyloxyphenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-oxolanylmethyl ester Oxolan-2-ylmethyl 4-(4-acetyloxyphenyl)-2-methyl-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Oxolan-2-ylmethyl 4-(4-acetyloxyphenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Tetrahydrofuran-2-ylmethyl 4-(4-acetoxyphenyl)-2-methyl-5-oxo-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Wiley ID 1463312