| SpectraBase Compound ID | IvMjF0lEVfh |
|---|---|
| InChI | InChI=1S/C13H13F3O4/c1-19-11(17)7-10(12(18)20-2)8-3-5-9(6-4-8)13(14,15)16/h3-6,10H,7H2,1-2H3 |
| InChIKey | ISQRHUSRUWJURP-UHFFFAOYSA-N |
| Mol Weight | 290.24 g/mol |
| Molecular Formula | C13H13F3O4 |
| Exact Mass | 290.076593 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 | G2zaiFMWpC7 |
|---|---|
| Name | (+)-dimethyl 2-(4-(trifluoromethyl)phenyl)succinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.076593384 u |
| Formula | C13H13F3O4 |
| InChI | InChI=1S/C13H13F3O4/c1-19-11(17)7-10(12(18)20-2)8-3-5-9(6-4-8)13(14,15)16/h3-6,10H,7H2,1-2H3 |
| InChIKey | ISQRHUSRUWJURP-UHFFFAOYSA-N |
| Molecular Weight | 290.238 g/mol |
| SMILES | C(C(CC(OC)=O)C1=CC=C(C=C1)C(F)(F)F)(=O)OC |