| SpectraBase Compound ID | 84Es9lShKW6 |
|---|---|
| InChI | InChI=1S/C13H8ClF2NO/c14-11-7-10(4-5-12(11)16)17-13(18)8-2-1-3-9(15)6-8/h1-7H,(H,17,18) |
| InChIKey | XKFYPXNUXJRJID-UHFFFAOYSA-N |
| Mol Weight | 267.66 g/mol |
| Molecular Formula | C13H8ClF2NO |
| Exact Mass | 267.026248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5nLwH3zc5LZ |
|---|---|
| Name | N-(3-Chloro-4-fluorophenyl)-3-fluorobenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.026247907 u |
| Formula | C13H8ClF2NO |
| InChI | InChI=1S/C13H8ClF2NO/c14-11-7-10(4-5-12(11)16)17-13(18)8-2-1-3-9(15)6-8/h1-7H,(H,17,18) |
| InChIKey | XKFYPXNUXJRJID-UHFFFAOYSA-N |
| Molecular Weight | 267.663 g/mol |
| SMILES | N(C(C=1C=C(F)C=CC1)=O)C=1C=C(Cl)C(=CC1)F |