![1-PHENYL-3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-o-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE](/api/spectrum/FyXQn64rKNx/structure.png?h=300&w=458 "1-PHENYL-3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-o-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE")
| SpectraBase Compound ID | 7QT6wLfwWtO |
|---|---|
| InChI | InChI=1S/C18H11F6N3O/c19-17(20,21)13-8-4-5-9-14(13)25-10-12-15(18(22,23)24)26-27(16(12)28)11-6-2-1-3-7-11/h1-10,25H |
| InChIKey | ORZJNUGBWYGBDP-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 | FyXQn64rKNx |
|---|---|
| Name | 1-phenyl-3-(trifluoromethyl)-4-[(alpha,alpha,alpha-trifluoro-o-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)13-8-4-5-9-14(13)25-10-12-15(18(22,23)24)26-27(16(12)28)11-6-2-1-3-7-11/h1-10,25H |
| InChIKey | ORZJNUGBWYGBDP-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57851M |
| Solvent | Polysol |