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4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid propyl ester
SpectraBase Compound ID ATKKmb4bQYS
InChI InChI=1S/C22H25F2NO3/c1-5-8-28-21(27)18-12(2)25-16-10-22(3,4)11-17(26)20(16)19(18)13-6-7-14(23)15(24)9-13/h6-7,9,19,25H,5,8,10-11H2,1-4H3
InChIKey HJEMXWGGIUQZOP-UHFFFAOYSA-N
Mol Weight 389.44 g/mol
Molecular Formula C22H25F2NO3
Exact Mass 389.18025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mViQRsnPGt
Name 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid propyl ester
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Formula C22H25F2NO3
InChI InChI=1S/C22H25F2NO3/c1-5-8-28-21(27)18-12(2)25-16-10-22(3,4)11-17(26)20(16)19(18)13-6-7-14(23)15(24)9-13/h6-7,9,19,25H,5,8,10-11H2,1-4H3
InChIKey HJEMXWGGIUQZOP-UHFFFAOYSA-N
Molecular Weight 389.443 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1cc(F)c(cc1)F)C(=O)OCCC)C
SPLASH splash10-004l-6692000000-d1c86e258d9325ee17a1
Synonyms 4-(3,4-difluorophenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid propyl ester Propyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Propyl 4-[3,4-bis(fluoranyl)phenyl]-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
Wiley ID 1453693