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3-PHENYL-4-[(alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE
SpectraBase Compound ID Ij5Ml4T57m
InChI InChI=1S/C17H12F3N3O/c18-17(19,20)12-6-8-13(9-7-12)21-10-14-15(22-23-16(14)24)11-4-2-1-3-5-11/h1-10,21H,(H,23,24)
InChIKey IHNMVALFEBJQGR-UHFFFAOYSA-N
Mol Weight 331.3 g/mol
Molecular Formula C17H12F3N3O
Exact Mass 331.093247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AY9SyRD18VE
Name 3-PHENYL-4-[(alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12F3N3O
InChI InChI=1S/C17H12F3N3O/c18-17(19,20)12-6-8-13(9-7-12)21-10-14-15(22-23-16(14)24)11-4-2-1-3-5-11/h1-10,21H,(H,23,24)
InChIKey IHNMVALFEBJQGR-UHFFFAOYSA-N
Melting Point 254-256C
Molecular Weight 331.30
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 2-PYRAZOLIN-5-ONE, 3-PHENYL- 4-//A,A,A-TRIFLUORO-P-TOLUIDINO/METHYLENE/-,