| SpectraBase Compound ID | tj0ifQrJsu |
|---|---|
| InChI | InChI=1S/C17H14N2O2/c20-16(14-9-5-2-6-10-14)15-11-18-19(17(15)21)12-13-7-3-1-4-8-13/h1-11,21H,12H2 |
| InChIKey | AXGMCNZTPNMPSC-UHFFFAOYSA-N |
| Mol Weight | 278.31 g/mol |
| Molecular Formula | C17H14N2O2 |
| Exact Mass | 278.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ymLqv6Qd9N |
|---|---|
| Name | (1-Benzyl-5-hydroxy-1H-pyrazol-4-yl)(phenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.105527697 u |
| Formula | C17H14N2O2 |
| InChI | InChI=1S/C17H14N2O2/c20-16(14-9-5-2-6-10-14)15-11-18-19(17(15)21)12-13-7-3-1-4-8-13/h1-11,21H,12H2 |
| InChIKey | AXGMCNZTPNMPSC-UHFFFAOYSA-N |
| SMILES | C(=O)(C=1C=CC=CC1)C=1C=NN(C1O)CC=1C=CC=CC1 |