![3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE](/api/spectrum/9SCTLhLohSI/structure.png?h=300&w=458 "3-(TRIFLUOROMETHYL)-4-[(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)METHYLENE]-2-PYRAZOLIN-5-ONE")
| SpectraBase Compound ID | GLMECyXECl0 |
|---|---|
| InChI | InChI=1S/C12H7F6N3O/c13-11(14,15)6-2-1-3-7(4-6)19-5-8-9(12(16,17)18)20-21-10(8)22/h1-5,19H,(H,21,22) |
| InChIKey | XZROVUWDELEQKG-UHFFFAOYSA-N |
| Mol Weight | 323.2 g/mol |
| Molecular Formula | C12H7F6N3O |
| Exact Mass | 323.049331 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9SCTLhLohSI |
|---|---|
| Name | 3-(trifluoromethyl)-4-[(alpha,alpha,alpha-trifluoro-m-toluidino)methylene]-2-pyrazolin-5-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H7F6N3O |
| InChI | InChI=1S/C12H7F6N3O/c13-11(14,15)6-2-1-3-7(4-6)19-5-8-9(12(16,17)18)20-21-10(8)22/h1-5,19H,(H,21,22) |
| InChIKey | XZROVUWDELEQKG-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57748M |
| Solvent | DMSO-d6 |