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O-{[1-(p-chlorophenyl)-5-propylpyrazol-4-yl]carbonyl}-alpha,alpha,alpha-trifluoro-p-toluamidoxime
SpectraBase Compound ID K1tFAzxSDWo
InChI InChI=1S/C21H18ClF3N4O2/c1-2-3-18-17(12-27-29(18)16-10-8-15(22)9-11-16)20(30)31-28-19(26)13-4-6-14(7-5-13)21(23,24)25/h4-12H,2-3H2,1H3,(H2,26,28)
InChIKey IQZKRATVRBJWRG-UHFFFAOYSA-N
Mol Weight 450.85 g/mol
Molecular Formula C21H18ClF3N4O2
Exact Mass 450.107038 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWnhFKcjtO0
Name O-{[1-(p-chlorophenyl)-5-propylpyrazol-4-yl]carbonyl}-alpha,alpha,alpha-trifluoro-p-toluamidoxime
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClF3N4O2
InChI InChI=1S/C21H18ClF3N4O2/c1-2-3-18-17(12-27-29(18)16-10-8-15(22)9-11-16)20(30)31-28-19(26)13-4-6-14(7-5-13)21(23,24)25/h4-12H,2-3H2,1H3,(H2,26,28)
InChIKey IQZKRATVRBJWRG-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 61027M
Solvent CDCl3