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4-(3-bromophenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester
SpectraBase Compound ID CxZvFfpEaTw
InChI InChI=1S/C25H24BrNO3/c1-16-22(25(29)30-14-13-17-7-3-2-4-8-17)23(18-9-5-10-19(26)15-18)24-20(27-16)11-6-12-21(24)28/h2-5,7-10,15,23,27H,6,11-14H2,1H3
InChIKey YYCPKEYMUVSLEI-UHFFFAOYSA-N
Mol Weight 466.38 g/mol
Molecular Formula C25H24BrNO3
Exact Mass 465.093957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HK9dIFbPvV2
Name 4-(3-bromophenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid phenethyl ester
Alternate Name(s) phenethyl 4-(3-bromophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate 4-(3-bromophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-phenylethyl ester 2-Phenylethyl 4-(3-bromophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
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Formula C25H24BrNO3
InChI InChI=1S/C25H24BrNO3/c1-16-22(25(29)30-14-13-17-7-3-2-4-8-17)23(18-9-5-10-19(26)15-18)24-20(27-16)11-6-12-21(24)28/h2-5,7-10,15,23,27H,6,11-14H2,1H3
InChIKey YYCPKEYMUVSLEI-UHFFFAOYSA-N
Molecular Weight 466.375 g/mol
SMILES N1C(=C(C(C=2C(CCCC12)=O)c1cc(Br)ccc1)C(=O)OCCc1ccccc1)C
SPLASH splash10-08fr-4957000000-512d5b49efc724ace9a4
Wiley ID 1454812