| SpectraBase Compound ID | F2w8oLtkao1 |
|---|---|
| InChI | InChI=1S/C12H12O4/c1-7-9-5-4-8(14-2)6-10(9)16-11(7)12(13)15-3/h4-6H,1-3H3 |
| InChIKey | QGKKCLCBJUUFMC-UHFFFAOYSA-N |
| Mol Weight | 220.22 g/mol |
| Molecular Formula | C12H12O4 |
| Exact Mass | 220.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GkeVKh2blvk |
|---|---|
| Name | 2-Benzofurancarboxylic acid, 6-methoxy-3-methyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.073558862 u |
| Formula | C12H12O4 |
| InChI | InChI=1S/C12H12O4/c1-7-9-5-4-8(14-2)6-10(9)16-11(7)12(13)15-3/h4-6H,1-3H3 |
| InChIKey | QGKKCLCBJUUFMC-UHFFFAOYSA-N |
| Molecular Weight | 220.224 g/mol |
| SMILES | C=1(OC2=CC(OC)=CC=C2C1C)C(=O)OC |