| SpectraBase Compound ID | JQ5ZZf8zAKS |
|---|---|
| InChI | InChI=1S/C14H13F3O5/c1-3-21-12(18)7-5-9-4-6-10(11(8-9)20-2)22-13(19)14(15,16)17/h4-8H,3H2,1-2H3/b7-5+ |
| InChIKey | ZUSXIUOYRVHOLJ-FNORWQNLSA-N |
| Mol Weight | 318.25 g/mol |
| Molecular Formula | C14H13F3O5 |
| Exact Mass | 318.071508 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9uE9YjwMq11 |
|---|---|
| Name | Ethyl 4-hydroxy-3-methoxycinnamate, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.071508003 u |
| Formula | C14H13F3O5 |
| InChI | InChI=1S/C14H13F3O5/c1-3-21-12(18)7-5-9-4-6-10(11(8-9)20-2)22-13(19)14(15,16)17/h4-8H,3H2,1-2H3/b7-5+ |
| InChIKey | ZUSXIUOYRVHOLJ-FNORWQNLSA-N |
| Molecular Weight | 318.248 g/mol |
| SMILES | C(\C=C\C1=CC(OC)=C(C=C1)OC(C(F)(F)F)=O)(OCC)=O |