![1-PHENYL-3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE](/api/spectrum/HMqjAYwaApc/structure.png?h=300&w=458 "1-PHENYL-3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-p-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE")
| SpectraBase Compound ID | KJmDCvM9uQI |
|---|---|
| InChI | InChI=1S/C18H11F6N3O/c19-17(20,21)11-6-8-12(9-7-11)25-10-14-15(18(22,23)24)26-27(16(14)28)13-4-2-1-3-5-13/h1-10,25H |
| InChIKey | SJRIOUMUGPELRZ-UHFFFAOYSA-N |
| Mol Weight | 399.3 g/mol |
| Molecular Formula | C18H11F6N3O |
| Exact Mass | 399.080631 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HMqjAYwaApc |
|---|---|
| Name | 1-phenyl-3-(trifluoromethyl)-4-[(alpha,alpha,alpha-trifluoro-p-toluidino)methylene]-2-pyrazolin-5-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H11F6N3O |
| InChI | InChI=1S/C18H11F6N3O/c19-17(20,21)11-6-8-12(9-7-11)25-10-14-15(18(22,23)24)26-27(16(14)28)13-4-2-1-3-5-13/h1-10,25H |
| InChIKey | SJRIOUMUGPELRZ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57853M |
| Solvent | Polysol |