| SpectraBase Compound ID | 4VNTMXLeGW5 |
|---|---|
| InChI | InChI=1S/C18H14O6/c1-22-12-4-2-11(3-5-12)18(21)15-9-24-16-7-6-13(8-14(15)16)23-10-17(19)20/h2-9H,10H2,1H3,(H,19,20) |
| InChIKey | MUIKEHPADSIXPE-UHFFFAOYSA-N |
| Mol Weight | 326.3 g/mol |
| Molecular Formula | C18H14O6 |
| Exact Mass | 326.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EY928yCRbt8 |
|---|---|
| Name | 3-(4-Methoxybenzoyl)-5-carboxymethyloxybenzofuran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.079038165 u |
| Formula | C18H14O6 |
| InChI | InChI=1S/C18H14O6/c1-22-12-4-2-11(3-5-12)18(21)15-9-24-16-7-6-13(8-14(15)16)23-10-17(19)20/h2-9H,10H2,1H3,(H,19,20) |
| InChIKey | MUIKEHPADSIXPE-UHFFFAOYSA-N |
| Molecular Weight | 326.304 g/mol |
| SMILES | OC(COc1cc2C(=COc2cc1)C(c1ccc(cc1)OC)=O)=O |