| SpectraBase Compound ID | 53JS5r5MyoU |
|---|---|
| InChI | InChI=1S/C18H16O6/c1-21-12-7-5-4-6-10(12)11-9-24-13-8-14(22-2)18(23-3)17(20)15(13)16(11)19/h4-9,20H,1-3H3 |
| InChIKey | ACMFUXOONUBCHZ-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 | 9TOucay8DNV |
|---|---|
| Name | 5-Hydroxy-2',6,7-trimethoxyisoflavone |
| 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/c1-21-12-7-5-4-6-10(12)11-9-24-13-8-14(22-2)18(23-3)17(20)15(13)16(11)19/h4-9,20H,1-3H3 |
| InChIKey | ACMFUXOONUBCHZ-UHFFFAOYSA-N |
| Molecular Weight | 328.320 g/mol |
| SMILES | OC=1C=2C(C(=COC2C=C(C1OC)OC)C=1C=CC=CC1OC)=O |