| SpectraBase Compound ID | BYG5ji0LLi4 |
|---|---|
| InChI | InChI=1S/C8H4Cl3FO2/c9-8(10,11)7(13)14-6-3-1-2-5(12)4-6/h1-4H |
| InChIKey | FHDDHARHGLZECL-UHFFFAOYSA-N |
| Mol Weight | 257.48 g/mol |
| Molecular Formula | C8H4Cl3FO2 |
| Exact Mass | 255.926091 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 | BF96abwZdqd |
|---|---|
| Name | Trichloroacetic acid, 3-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.926090630 u |
| Formula | C8H4Cl3FO2 |
| InChI | InChI=1S/C8H4Cl3FO2/c9-8(10,11)7(13)14-6-3-1-2-5(12)4-6/h1-4H |
| InChIKey | FHDDHARHGLZECL-UHFFFAOYSA-N |
| Molecular Weight | 257.475 g/mol |
| SMILES | C(C(=O)OC1=CC=CC(=C1)F)(Cl)(Cl)Cl |