| SpectraBase Compound ID | 8bNiivKciBB |
|---|---|
| InChI | InChI=1S/C16H10Cl2O3/c1-20-10-3-5-12-14(19)8-16(21-15(12)7-10)11-4-2-9(17)6-13(11)18/h2-8H,1H3 |
| InChIKey | JNVZEGGFENUXPZ-UHFFFAOYSA-N |
| Mol Weight | 321.16 g/mol |
| Molecular Formula | C16H10Cl2O3 |
| Exact Mass | 320.0007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Dg6nsyI0HD |
|---|---|
| Name | 2-(2,4-Dichlorophenyl)-7-methoxychromen-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.000699579 u |
| Formula | C16H10Cl2O3 |
| InChI | InChI=1S/C16H10Cl2O3/c1-20-10-3-5-12-14(19)8-16(21-15(12)7-10)11-4-2-9(17)6-13(11)18/h2-8H,1H3 |
| InChIKey | JNVZEGGFENUXPZ-UHFFFAOYSA-N |
| Molecular Weight | 321.159 g/mol |
| SMILES | C1(=CC(=O)C=2C(O1)=CC(OC)=CC2)C1=C(C=C(C=C1)Cl)Cl |