| SpectraBase Compound ID | 4yHGdG8U4f8 |
|---|---|
| InChI | InChI=1S/C23H19N3O/c1-17-9-8-12-19(15-17)24-23(27)21-16-26(20-13-6-3-7-14-20)25-22(21)18-10-4-2-5-11-18/h2-16H,1H3,(H,24,27) |
| InChIKey | ALCYRTJAWJYDPJ-UHFFFAOYSA-N |
| Mol Weight | 353.43 g/mol |
| Molecular Formula | C23H19N3O |
| Exact Mass | 353.152812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K5fvB97k9Qr |
|---|---|
| Name | 3-Phenyl-4-(3-methylphenyl)carbamoylpyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.152812243 u |
| Formula | C23H19N3O |
| InChI | InChI=1S/C23H19N3O/c1-17-9-8-12-19(15-17)24-23(27)21-16-26(20-13-6-3-7-14-20)25-22(21)18-10-4-2-5-11-18/h2-16H,1H3,(H,24,27) |
| InChIKey | ALCYRTJAWJYDPJ-UHFFFAOYSA-N |
| Molecular Weight | 353.425 g/mol |
| SMILES | N(C(C1=CN(N=C1c1ccccc1)c1ccccc1)=O)c1cc(ccc1)C |