| SpectraBase Compound ID | ABT92Qyes5E |
|---|---|
| InChI | InChI=1S/C13H14O6/c1-8(14)19-13-10(17-2)6-9(4-5-12(15)16)7-11(13)18-3/h4-7H,1-3H3,(H,15,16)/b5-4+ |
| InChIKey | ATOGPJBNWPDOAB-SNAWJCMRSA-N |
| Mol Weight | 266.25 g/mol |
| Molecular Formula | C13H14O6 |
| Exact Mass | 266.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KTnyeuiPBqV |
|---|---|
| Name | 4-Acetoxy-3,5-dimethoxycinnamic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.079038165 u |
| Formula | C13H14O6 |
| InChI | InChI=1S/C13H14O6/c1-8(14)19-13-10(17-2)6-9(4-5-12(15)16)7-11(13)18-3/h4-7H,1-3H3,(H,15,16)/b5-4+ |
| InChIKey | ATOGPJBNWPDOAB-SNAWJCMRSA-N |
| Molecular Weight | 266.249 g/mol |
| SMILES | C=1(C(=CC(\C=C\C(=O)O)=CC1OC)OC)OC(=O)C |