| SpectraBase Compound ID | KVQeINOtDDu |
|---|---|
| InChI | InChI=1S/C18H16O6/c1-21-11-5-6-12-15(9-11)24-17(18(23-3)16(12)20)10-4-7-14(22-2)13(19)8-10/h4-9,19H,1-3H3 |
| InChIKey | FDUFENASKFWNKM-UHFFFAOYSA-N |
| Mol Weight | 328.32 g/mol |
| Molecular Formula | C18H16O6 |
| Exact Mass | 328.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CxqSpALrHuS |
|---|---|
| Name | 2-(3-Hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-chromen-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.094688229 u |
| Formula | C18H16O6 |
| InChI | InChI=1S/C18H16O6/c1-21-11-5-6-12-15(9-11)24-17(18(23-3)16(12)20)10-4-7-14(22-2)13(19)8-10/h4-9,19H,1-3H3 |
| InChIKey | FDUFENASKFWNKM-UHFFFAOYSA-N |
| Molecular Weight | 328.320 g/mol |
| SMILES | C12=C(OC(=C(C2=O)OC)C2=CC=C(C(=C2)O)OC)C=C(C=C1)OC |