![4-{[(p-methoxybenzyl)amino]methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one](/api/spectrum/3oCNMHJZrqT/structure.png?h=300&w=458 "4-{[(p-methoxybenzyl)amino]methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one")
| SpectraBase Compound ID | 7MtDVsDi2Iy |
|---|---|
| InChI | InChI=1S/C13H12F3N3O2/c1-21-9-4-2-8(3-5-9)6-17-7-10-11(13(14,15)16)18-19-12(10)20/h2-5,7,17H,6H2,1H3,(H,19,20) |
| InChIKey | HFLSUEQEIUOWIJ-UHFFFAOYSA-N |
| Mol Weight | 299.25 g/mol |
| Molecular Formula | C13H12F3N3O2 |
| Exact Mass | 299.088161 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3oCNMHJZrqT |
|---|---|
| Name | 4-{[(p-methoxybenzyl)amino]methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H12F3N3O2 |
| InChI | InChI=1S/C13H12F3N3O2/c1-21-9-4-2-8(3-5-9)6-17-7-10-11(13(14,15)16)18-19-12(10)20/h2-5,7,17H,6H2,1H3,(H,19,20) |
| InChIKey | HFLSUEQEIUOWIJ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57778M |
| Solvent | Polysol |