| SpectraBase Compound ID | AIr2o4sTFjq |
|---|---|
| InChI | InChI=1S/C19H14N2O2/c1-13-11-17(21(20-13)15-8-3-2-4-9-15)16-12-14-7-5-6-10-18(14)23-19(16)22/h2-12H,1H3 |
| InChIKey | OCLYACLPTIBZMN-UHFFFAOYSA-N |
| Mol Weight | 302.33 g/mol |
| Molecular Formula | C19H14N2O2 |
| Exact Mass | 302.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4xNOtPE08eO |
|---|---|
| Name | 3-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-2H-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.105527697 u |
| Formula | C19H14N2O2 |
| InChI | InChI=1S/C19H14N2O2/c1-13-11-17(21(20-13)15-8-3-2-4-9-15)16-12-14-7-5-6-10-18(14)23-19(16)22/h2-12H,1H3 |
| InChIKey | OCLYACLPTIBZMN-UHFFFAOYSA-N |
| SMILES | C1=CC=C2C(=C1)C=C(C1=CC(=NN1C1=CC=CC=C1)C)C(=O)O2 |