| SpectraBase Compound ID | 4OUnl3nws8d |
|---|---|
| InChI | InChI=1S/C16H11ClO3/c1-19-12-6-7-13-14(18)9-15(20-16(13)8-12)10-2-4-11(17)5-3-10/h2-9H,1H3 |
| InChIKey | SQLUWUXBLLPJIY-UHFFFAOYSA-N |
| Mol Weight | 286.71 g/mol |
| Molecular Formula | C16H11ClO3 |
| Exact Mass | 286.039672 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fA2lIcDPm1 |
|---|---|
| Name | 2-(4-Chlorophenyl)-7-methoxy-1-benzopyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.039671911 u |
| Formula | C16H11ClO3 |
| InChI | InChI=1S/C16H11ClO3/c1-19-12-6-7-13-14(18)9-15(20-16(13)8-12)10-2-4-11(17)5-3-10/h2-9H,1H3 |
| InChIKey | SQLUWUXBLLPJIY-UHFFFAOYSA-N |
| SMILES | C1(=CC(=O)C=2C=CC(=CC2O1)OC)C=1C=CC(=CC1)Cl |