| SpectraBase Compound ID | 9n97OdJeuXB |
|---|---|
| InChI | InChI=1S/C14H16O6/c1-9(2)19-14(17)20-12-8-10(5-7-13(15)16)4-6-11(12)18-3/h4-9H,1-3H3,(H,15,16)/b7-5+ |
| InChIKey | ZVPDNGJUGHZKNA-FNORWQNLSA-N |
| Mol Weight | 280.28 g/mol |
| Molecular Formula | C14H16O6 |
| Exact Mass | 280.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IwkqNAVpZha |
|---|---|
| Name | Trans-3-(isopropyloxycarbonyl)oxy-4-methoxycinnamic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.094688229 u |
| Formula | C14H16O6 |
| InChI | InChI=1S/C14H16O6/c1-9(2)19-14(17)20-12-8-10(5-7-13(15)16)4-6-11(12)18-3/h4-9H,1-3H3,(H,15,16)/b7-5+ |
| InChIKey | ZVPDNGJUGHZKNA-FNORWQNLSA-N |
| SMILES | C1=C(C=CC(=C1OC(OC(C)C)=O)OC)\C=C\C(O)=O |