| SpectraBase Compound ID | IQ9nNdywh5w |
|---|---|
| InChI | InChI=1S/C17H14O5/c1-20-14-8-7-10(9-12(14)18)16-17(21-2)15(19)11-5-3-4-6-13(11)22-16/h3-9,18H,1-2H3 |
| InChIKey | AZHLWAUYEUEQAA-UHFFFAOYSA-N |
| Mol Weight | 298.29 g/mol |
| Molecular Formula | C17H14O5 |
| Exact Mass | 298.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6crNeuT34j2 |
|---|---|
| Name | 2-(3-Hydroxy-4-methoxyphenyl)-3-methoxy-4H-chromen-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.084123546 u |
| Formula | C17H14O5 |
| InChI | InChI=1S/C17H14O5/c1-20-14-8-7-10(9-12(14)18)16-17(21-2)15(19)11-5-3-4-6-13(11)22-16/h3-9,18H,1-2H3 |
| InChIKey | AZHLWAUYEUEQAA-UHFFFAOYSA-N |
| Molecular Weight | 298.294 g/mol |
| SMILES | C12=C(OC(=C(C2=O)OC)C2=CC(=C(OC)C=C2)O)C=CC=C1 |