| SpectraBase Compound ID | IvFgZIw8rQ4 |
|---|---|
| InChI | InChI=1S/C17H14N2O/c20-17(14-9-5-2-6-10-14)12-15-11-16(19-18-15)13-7-3-1-4-8-13/h1-11H,12H2,(H,18,19) |
| InChIKey | AOTVZMQJJFQFNR-UHFFFAOYSA-N |
| Mol Weight | 262.31 g/mol |
| Molecular Formula | C17H14N2O |
| Exact Mass | 262.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DWm40dW1tWO |
|---|---|
| Name | 1-Phenyl-2-(3-phenyl-1H-pyrazol-5-yl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.110613078 u |
| Formula | C17H14N2O |
| InChI | InChI=1S/C17H14N2O/c20-17(14-9-5-2-6-10-14)12-15-11-16(19-18-15)13-7-3-1-4-8-13/h1-11H,12H2,(H,18,19) |
| InChIKey | AOTVZMQJJFQFNR-UHFFFAOYSA-N |
| Molecular Weight | 262.312 g/mol |
| SMILES | C=1(NN=C(C1)CC(=O)C=1C=CC=CC1)C=1C=CC=CC1 |