| SpectraBase Compound ID | LvMmlEe3Ei |
|---|---|
| InChI | InChI=1S/C18H16O6/c1-21-10-8-13(22-2)15(14(9-10)23-3)16-17(19)11-6-4-5-7-12(11)24-18(16)20/h4-9,19H,1-3H3 |
| InChIKey | JAZUDQAXYMYHTL-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 | 1g4OaGBAexo |
|---|---|
| Name | 4-Hydroxy-3-(2,4,6-trimethyloxyphenyl)-1-benzopyran-2-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/c1-21-10-8-13(22-2)15(14(9-10)23-3)16-17(19)11-6-4-5-7-12(11)24-18(16)20/h4-9,19H,1-3H3 |
| InChIKey | JAZUDQAXYMYHTL-UHFFFAOYSA-N |
| Molecular Weight | 328.320 g/mol |
| SMILES | C1(=C(C2=CC=CC=C2OC1=O)O)C=1C(=CC(=CC1OC)OC)OC |