| SpectraBase Compound ID | CABXBgxqqdf |
|---|---|
| InChI | InChI=1S/C21H13FO3/c22-16-8-6-13(7-9-16)15-10-17(23)21-18(24)12-19(25-20(21)11-15)14-4-2-1-3-5-14/h1-12,23H |
| InChIKey | ZMMSIQIZCSKWNN-UHFFFAOYSA-N |
| Mol Weight | 332.33 g/mol |
| Molecular Formula | C21H13FO3 |
| Exact Mass | 332.084872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DaCtu7HKueZ |
|---|---|
| Name | 7-(4-Fluorophenyl)-5-hydroxy-2-phenyl-4H-chromen-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.084872439 u |
| Formula | C21H13FO3 |
| InChI | InChI=1S/C21H13FO3/c22-16-8-6-13(7-9-16)15-10-17(23)21-18(24)12-19(25-20(21)11-15)14-4-2-1-3-5-14/h1-12,23H |
| InChIKey | ZMMSIQIZCSKWNN-UHFFFAOYSA-N |
| Molecular Weight | 332.330 g/mol |
| SMILES | C=12C(C=C(OC2=CC(=CC1O)C1=CC=C(C=C1)F)C1=CC=CC=C1)=O |