![4-{{[(3-pyridyl)methyl]amino}methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one](/api/spectrum/F14sxsXIgKY/structure.png?h=300&w=458 "4-{{[(3-pyridyl)methyl]amino}methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one")
| SpectraBase Compound ID | 2gCoRkS4VAx |
|---|---|
| InChI | InChI=1S/C11H9F3N4O/c12-11(13,14)9-8(10(19)18-17-9)6-16-5-7-2-1-3-15-4-7/h1-4,6,16H,5H2,(H,18,19) |
| InChIKey | KGYFHCTYEJMRAT-UHFFFAOYSA-N |
| Mol Weight | 270.22 g/mol |
| Molecular Formula | C11H9F3N4O |
| Exact Mass | 270.072845 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F14sxsXIgKY |
|---|---|
| Name | 4-{{[(3-pyridyl)methyl]amino}methylene}-3-(trifluoromethyl)-2-pyrazolin-5-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9F3N4O |
| InChI | InChI=1S/C11H9F3N4O/c12-11(13,14)9-8(10(19)18-17-9)6-16-5-7-2-1-3-15-4-7/h1-4,6,16H,5H2,(H,18,19) |
| InChIKey | KGYFHCTYEJMRAT-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57794M |
| Solvent | Polysol |