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4-{[5-hydroxy-1-phenyl-3-(trifluoromethyl)pyrazol-4-yl]methylene}-1-phenyl-3-(trifluoromethyl)-2-pyrazolin-5-one
SpectraBase Compound ID 7DT82eD31T9
InChI InChI=1S/C21H12F6N4O2/c22-20(23,24)16-14(18(32)30(28-16)12-7-3-1-4-8-12)11-15-17(21(25,26)27)29-31(19(15)33)13-9-5-2-6-10-13/h1-11,32H
InChIKey MIIYDAGTPLRVGJ-UHFFFAOYSA-N
Mol Weight 466.34 g/mol
Molecular Formula C21H12F6N4O2
Exact Mass 466.086445 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E93fPTfref5
Name 4-{[5-HYDROXY-1-PHENYL-3-(TRIFLUOROMETHYL)PYRAZOL-4-YL]METHYLENE}-1-PHENYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12F6N4O2
InChI InChI=1S/C21H12F6N4O2/c22-20(23,24)16-14(18(32)30(28-16)12-7-3-1-4-8-12)11-15-17(21(25,26)27)29-31(19(15)33)13-9-5-2-6-10-13/h1-11,32H
InChIKey MIIYDAGTPLRVGJ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 219-220C
Molecular Weight 466.35
Solvent CDCl3; Reference=TMS; Temperature 297K