| SpectraBase Compound ID | 9kpEDoSL6Dd |
|---|---|
| InChI | InChI=1S/C20H17N3O/c1-14-19(18-13-12-15-8-6-7-11-17(15)21-18)20(24)23(22(14)2)16-9-4-3-5-10-16/h3-13H,1-2H3 |
| InChIKey | JRHSMTCQUAUUIM-UHFFFAOYSA-N |
| Mol Weight | 315.38 g/mol |
| Molecular Formula | C20H17N3O |
| Exact Mass | 315.137162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4DsDmdSuVBY |
|---|---|
| Name | 2,3-Dimethyl-5-oxo-1-phenyl-4-(2-quinolyl)-3-pyrazoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.137162178 u |
| Formula | C20H17N3O |
| InChI | InChI=1S/C20H17N3O/c1-14-19(18-13-12-15-8-6-7-11-17(15)21-18)20(24)23(22(14)2)16-9-4-3-5-10-16/h3-13H,1-2H3 |
| InChIKey | JRHSMTCQUAUUIM-UHFFFAOYSA-N |
| Molecular Weight | 315.376 g/mol |
| SMILES | C=1(N(N(C(C1C1=CC=C2C(=N1)C=CC=C2)=O)C1=CC=CC=C1)C)C |