| SpectraBase Compound ID | 278JDDVr2aD |
|---|---|
| InChI | InChI=1S/C19H14N2O2/c1-13-9-10-21(20-13)16-8-7-15-11-17(14-5-3-2-4-6-14)19(22)23-18(15)12-16/h2-12H,1H3 |
| InChIKey | HATLMHBLUAELGS-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 | J89617xraqs |
|---|---|
| Name | 2H-1-Benzopyran-2-one, 7-(3-methyl-1H-pyrazol-1-yl)-3-phenyl- |
| 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/c1-13-9-10-21(20-13)16-8-7-15-11-17(14-5-3-2-4-6-14)19(22)23-18(15)12-16/h2-12H,1H3 |
| InChIKey | HATLMHBLUAELGS-UHFFFAOYSA-N |
| SMILES | C1(C(=CC=2C(O1)=CC(N1C=CC(=N1)C)=CC2)C1=CC=CC=C1)=O |