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6-TRIFLUOROMETHYL-1,4,5,6-TETRAHYDRO-3-(4-METHOXYPHENYL)-1,4-DIPHENYL-1,2,4-TRIAZIN-6-OL
SpectraBase Compound ID I5Dk8IR7sXC
InChI InChI=1S/C23H20F3N3O2/c1-31-20-14-12-17(13-15-20)21-27-29(19-10-6-3-7-11-19)22(30,23(24,25)26)16-28(21)18-8-4-2-5-9-18/h2-15,30H,16H2,1H3
InChIKey HVLYWIQJTCYUJA-UHFFFAOYSA-N
Mol Weight 427.43 g/mol
Molecular Formula C23H20F3N3O2
Exact Mass 427.150761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUoWgwuV9x6
Name 6-TRIFLUOROMETHYL-1,4,5,6-TETRAHYDRO-3-(4-METHOXYPHENYL)-1,4-DIPHENYL-1,2,4-TRIAZIN-6-OL
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20F3N3O2
InChI InChI=1S/C23H20F3N3O2/c1-31-20-14-12-17(13-15-20)21-27-29(19-10-6-3-7-11-19)22(30,23(24,25)26)16-28(21)18-8-4-2-5-9-18/h2-15,30H,16H2,1H3
InChIKey HVLYWIQJTCYUJA-UHFFFAOYSA-N
Literature Reference Author M.KAWASE,H.KOIWAI
Literature Reference Citation CHEM.PHARM.BULL.,56,433(2008)
Literature Reference DOI 10.1248/cpb.56.433
Molecular Weight 427.426 g/mol
Sample ID 1456
Solvent CDCl3