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1-(4-Ethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID 7UpEZHg98R0
InChI InChI=1S/C26H26F3NO5/c1-4-33-20-12-10-19(11-13-20)30-15-21(24(31)34-5-2)23(22(16-30)25(32)35-6-3)17-8-7-9-18(14-17)26(27,28)29/h7-16,23H,4-6H2,1-3H3
InChIKey PPBBDBVGYVHRPU-UHFFFAOYSA-N
Mol Weight 489.49 g/mol
Molecular Formula C26H26F3NO5
Exact Mass 489.176307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHvh7ZYO0QK
Name 1-(4-Ethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester
Alternate Name(s) 1-p-phenetyl-4-[3-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester Diethyl 1-(4-ethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylate
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Formula C26H26F3NO5
InChI InChI=1S/C26H26F3NO5/c1-4-33-20-12-10-19(11-13-20)30-15-21(24(31)34-5-2)23(22(16-30)25(32)35-6-3)17-8-7-9-18(14-17)26(27,28)29/h7-16,23H,4-6H2,1-3H3
InChIKey PPBBDBVGYVHRPU-UHFFFAOYSA-N
Molecular Weight 489.491 g/mol
SMILES C=1(C(C(C(=O)OCC)=CN(C1)c1ccc(cc1)OCC)c1cc(C(F)(F)F)ccc1)C(=O)OCC
SPLASH splash10-0006-0239200000-b72a5b16f3a999f7a772
Wiley ID 1462220