| SpectraBase Compound ID | 3bsRd0MXy3d |
|---|---|
| InChI | InChI=1S/C12H12O6/c1-6(13)17-12-10-8(11(14)18-12)4-7(15-2)5-9(10)16-3/h4-5,12H,1-3H3 |
| InChIKey | JUMQZWBLPIKEHI-UHFFFAOYSA-N |
| Mol Weight | 252.22 g/mol |
| Molecular Formula | C12H12O6 |
| Exact Mass | 252.063388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 64Isvm5PQ84 |
|---|---|
| Name | (5,7-Dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl) ethanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.063388100 u |
| Formula | C12H12O6 |
| InChI | InChI=1S/C12H12O6/c1-6(13)17-12-10-8(11(14)18-12)4-7(15-2)5-9(10)16-3/h4-5,12H,1-3H3 |
| InChIKey | JUMQZWBLPIKEHI-UHFFFAOYSA-N |
| Molecular Weight | 252.222 g/mol |
| SMILES | C1=2C(OC(C2C=C(C=C1OC)OC)=O)OC(=O)C |