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4-(6-Chloro-1,3-benzodioxol-5-yl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester
SpectraBase Compound ID ABuP1zjte0z
InChI InChI=1S/C26H24ClNO5/c1-15-23(26(30)31-11-10-16-6-3-2-4-7-16)24(25-19(28-15)8-5-9-20(25)29)17-12-21-22(13-18(17)27)33-14-32-21/h2-4,6-7,12-13,24,28H,5,8-11,14H2,1H3
InChIKey FMFSFBLPWRDCBV-UHFFFAOYSA-N
Mol Weight 465.93 g/mol
Molecular Formula C26H24ClNO5
Exact Mass 465.134301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGXhP0Xzyv8
Name 4-(6-Chloro-1,3-benzodioxol-5-yl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester
Alternate Name(s) phenethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 4-(6-Chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-phenylethyl ester 2-Phenylethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C26H24ClNO5
InChI InChI=1S/C26H24ClNO5/c1-15-23(26(30)31-11-10-16-6-3-2-4-7-16)24(25-19(28-15)8-5-9-20(25)29)17-12-21-22(13-18(17)27)33-14-32-21/h2-4,6-7,12-13,24,28H,5,8-11,14H2,1H3
InChIKey FMFSFBLPWRDCBV-UHFFFAOYSA-N
Molecular Weight 465.933 g/mol
SMILES N1C(=C(C(C=2C(CCCC12)=O)c1c(cc2c(c1)OCO2)Cl)C(=O)OCCc1ccccc1)C
SPLASH splash10-0bt9-4955100000-1f9530ddbb8651fb4e17
Wiley ID 1455008