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1-METHYL-5-TRIFLUOROMETHYL-1H-PYRAZOL-3-OL
SpectraBase Compound ID 7q3CqT7Jrtx
InChI InChI=1S/C5H5F3N2O/c1-10-3(5(6,7)8)2-4(11)9-10/h2H,1H3,(H,9,11)
InChIKey QEHXHKNBIGEWIH-UHFFFAOYSA-N
Mol Weight 166.1 g/mol
Molecular Formula C5H5F3N2O
Exact Mass 166.035397 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8bRxG69l7Xv
Name 1-METHYL-5-TRIFLUOROMETHYL-1H-PYRAZOL-3-OL
Comments EXTERNAL STANDARD-PHCF3 (-63.763 FROM CFCL3).;19F-56.4MHZ
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H5F3N2O
InChI InChI=1S/C5H5F3N2O/c1-10-3(5(6,7)8)2-4(11)9-10/h2H,1H3,(H,9,11)
InChIKey QEHXHKNBIGEWIH-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference BRUCE C. HAMPER (1990) J.Fluor.Chem.: v.48, N1, 123-131.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6