| SpectraBase Compound ID | 2zzCD3ZCdqR |
|---|---|
| InChI | InChI=1S/C14H7Cl2F3O/c15-11-5-4-9(7-12(11)16)13(20)8-2-1-3-10(6-8)14(17,18)19/h1-7H |
| InChIKey | RFNRBFCXUFMYRI-UHFFFAOYSA-N |
| Mol Weight | 319.11 g/mol |
| Molecular Formula | C14H7Cl2F3O |
| Exact Mass | 317.982605 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mDEUfiDQUL |
|---|---|
| Name | 3-Trifluoromethyl-3',4'-dichlorobenzophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.982604733 u |
| Formula | C14H7Cl2F3O |
| InChI | InChI=1S/C14H7Cl2F3O/c15-11-5-4-9(7-12(11)16)13(20)8-2-1-3-10(6-8)14(17,18)19/h1-7H |
| InChIKey | RFNRBFCXUFMYRI-UHFFFAOYSA-N |
| Molecular Weight | 319.110 g/mol |
| SMILES | C1=C(C(C2=CC=C(C(=C2)Cl)Cl)=O)C=CC=C1C(F)(F)F |