| SpectraBase Compound ID | Aw3fKnOWaXy |
|---|---|
| InChI | InChI=1S/C13H14O7/c1-7(14)19-12-10(17-3)5-9(6-11(12)18-4)13(16)20-8(2)15/h5-6H,1-4H3 |
| InChIKey | WJPRTAICBHBCON-UHFFFAOYSA-N |
| Mol Weight | 282.25 g/mol |
| Molecular Formula | C13H14O7 |
| Exact Mass | 282.073953 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EqWrlG7ixJy |
|---|---|
| Name | Acetic 4-acetoxy-3,5-dimethoxybenzoic anhydride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.073952784 u |
| Formula | C13H14O7 |
| InChI | InChI=1S/C13H14O7/c1-7(14)19-12-10(17-3)5-9(6-11(12)18-4)13(16)20-8(2)15/h5-6H,1-4H3 |
| InChIKey | WJPRTAICBHBCON-UHFFFAOYSA-N |
| SMILES | COC1=C(OC(C)=O)C(OC)=CC(=C1)C(OC(C)=O)=O |