| SpectraBase Compound ID | 3KuLYNbWC7d |
|---|---|
| InChI | InChI=1S/C16H16O6/c1-19-11-6-4-5-7-12(11)22-13-9-15(21-3)14(20-2)8-10(13)16(17)18/h4-9H,1-3H3,(H,17,18) |
| InChIKey | MQLWBDAJOFBBLA-UHFFFAOYSA-N |
| Mol Weight | 304.3 g/mol |
| Molecular Formula | C16H16O6 |
| Exact Mass | 304.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7xe1iG8K2xB |
|---|---|
| Name | 4,5-Dimethoxy-2-(o-methoxyphenoxy)benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.094688229 u |
| Formula | C16H16O6 |
| InChI | InChI=1S/C16H16O6/c1-19-11-6-4-5-7-12(11)22-13-9-15(21-3)14(20-2)8-10(13)16(17)18/h4-9H,1-3H3,(H,17,18) |
| InChIKey | MQLWBDAJOFBBLA-UHFFFAOYSA-N |
| Molecular Weight | 304.298 g/mol |
| SMILES | C1(=C(C=C(C(=C1)OC)OC)C(=O)O)OC1=CC=CC=C1OC |