![3-(trifluoromethyl)-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one](/api/spectrum/OtWzYYqRmw/structure.png?h=300&w=458 "3-(trifluoromethyl)-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one")
| SpectraBase Compound ID | IU9WF2yv1ko |
|---|---|
| InChI | InChI=1S/C13H9F6N3O/c14-12(15,16)8-3-1-2-7(4-8)5-20-6-9-10(13(17,18)19)21-22-11(9)23/h1-4,6,20H,5H2,(H,22,23) |
| InChIKey | ABALIUONNHETAO-UHFFFAOYSA-N |
| Mol Weight | 337.23 g/mol |
| Molecular Formula | C13H9F6N3O |
| Exact Mass | 337.064981 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | OtWzYYqRmw |
|---|---|
| Name | 3-(trifluoromethyl)-4-{{[m-(trifluoromethyl)benzyl]amino}methylene}-2-pyrazolin-5-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9F6N3O |
| InChI | InChI=1S/C13H9F6N3O/c14-12(15,16)8-3-1-2-7(4-8)5-20-6-9-10(13(17,18)19)21-22-11(9)23/h1-4,6,20H,5H2,(H,22,23) |
| InChIKey | ABALIUONNHETAO-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57835M |
| Solvent | Polysol |