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1,4-Dihydro-2,4-diphenyl-3-(3-methylisoxazol-5-yl)-6-(trifluoromethyl)pyridine
SpectraBase Compound ID KU7JwCEGky9
InChI InChI=1S/C22H17F3N2O/c1-14-12-18(28-27-14)20-17(15-8-4-2-5-9-15)13-19(22(23,24)25)26-21(20)16-10-6-3-7-11-16/h2-13,17,26H,1H3
InChIKey FZRWMMOOVAITEU-UHFFFAOYSA-N
Mol Weight 382.39 g/mol
Molecular Formula C22H17F3N2O
Exact Mass 382.129298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1NANMHrEU3
Name 1,4-Dihydro-2,4-diphenyl-3-(3-methylisoxazol-5-yl)-6-(trifluoromethyl)pyridine
Alternate Name(s) 3-(3-methyl-5-isoxazolyl)-2,4-diphenyl-6-(trifluoromethyl)-1,4-dihydropyridine
Comments Less than 3 mono-isotopic peaks
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Formula C22H17F3N2O
InChI InChI=1S/C22H17F3N2O/c1-14-12-18(28-27-14)20-17(15-8-4-2-5-9-15)13-19(22(23,24)25)26-21(20)16-10-6-3-7-11-16/h2-13,17,26H,1H3
InChIKey FZRWMMOOVAITEU-UHFFFAOYSA-N
Molecular Weight 382.386 g/mol
SMILES N1C(=CC(C(=C1c1ccccc1)c1onc(c1)C)c1ccccc1)C(F)(F)F
SPLASH splash10-0a59-0009000000-8405c5c8c5d42d3aa9af
Source of Spectrum KC-0-2805-5
Wiley ID 829039