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(phenylmethyl) 4-[3,4-bis(fluoranyl)phenyl]-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
SpectraBase Compound ID 8NQNRufek5S
InChI InChI=1S/C26H25F2NO3/c1-15-22(25(31)32-14-16-7-5-4-6-8-16)23(17-9-10-18(27)19(28)11-17)24-20(29-15)12-26(2,3)13-21(24)30/h4-11,23,29H,12-14H2,1-3H3
InChIKey HVUWVUHNSBZCNF-UHFFFAOYSA-N
Mol Weight 437.49 g/mol
Molecular Formula C26H25F2NO3
Exact Mass 437.18025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIWjBJwKfO2
Name (phenylmethyl) 4-[3,4-bis(fluoranyl)phenyl]-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
Alternate Name(s) 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid (phenylmethyl) ester 4-(3,4-difluorophenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid benzyl ester benzyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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Formula C26H25F2NO3
InChI InChI=1S/C26H25F2NO3/c1-15-22(25(31)32-14-16-7-5-4-6-8-16)23(17-9-10-18(27)19(28)11-17)24-20(29-15)12-26(2,3)13-21(24)30/h4-11,23,29H,12-14H2,1-3H3
InChIKey HVUWVUHNSBZCNF-UHFFFAOYSA-N
Molecular Weight 437.487 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1cc(F)c(cc1)F)C(OCc1ccccc1)=O)C
SPLASH splash10-0006-9422000000-5527b5370e7ce1a901bd
Wiley ID 1462320