SpectraBase Compound ID | K1tFAzxSDWo |
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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 |
SpectraBase Spectrum ID | JWnhFKcjtO0 |
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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 |