| SpectraBase Compound ID | IVHzAtFhFxm |
|---|---|
| InChI | InChI=1S/C14H8F4O2/c15-9-4-3-5-10(8-9)20-13(19)11-6-1-2-7-12(11)14(16,17)18/h1-8H |
| InChIKey | MWTSZYAHBXWPMA-UHFFFAOYSA-N |
| Mol Weight | 284.21 g/mol |
| Molecular Formula | C14H8F4O2 |
| Exact Mass | 284.046042 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 | B1Ebkxd2a5m |
|---|---|
| Name | 2-Trifluoromethylbenzoic acid, 3-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.046042148 u |
| Formula | C14H8F4O2 |
| InChI | InChI=1S/C14H8F4O2/c15-9-4-3-5-10(8-9)20-13(19)11-6-1-2-7-12(11)14(16,17)18/h1-8H |
| InChIKey | MWTSZYAHBXWPMA-UHFFFAOYSA-N |
| Molecular Weight | 284.210 g/mol |
| SMILES | C1(=CC=CC=C1C(=O)OC1=CC=CC(=C1)F)C(F)(F)F |