| SpectraBase Compound ID | BD1kCtADDUA |
|---|---|
| InChI | InChI=1S/C16H13F4NO/c1-21(10-11-5-3-2-4-6-11)15(22)13-9-12(16(18,19)20)7-8-14(13)17/h2-9H,10H2,1H3 |
| InChIKey | NIYMFPPLOULIMS-UHFFFAOYSA-N |
| Mol Weight | 311.28 g/mol |
| Molecular Formula | C16H13F4NO |
| Exact Mass | 311.093327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAd2ndrvDed |
|---|---|
| Name | Benzamide, 2-fluoro-5-trifluoromethyl-N-benzyl-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.093326694 u |
| Formula | C16H13F4NO |
| InChI | InChI=1S/C16H13F4NO/c1-21(10-11-5-3-2-4-6-11)15(22)13-9-12(16(18,19)20)7-8-14(13)17/h2-9H,10H2,1H3 |
| InChIKey | NIYMFPPLOULIMS-UHFFFAOYSA-N |
| Molecular Weight | 311.280 g/mol |
| SMILES | C1=C(C=CC(=C1C(N(C)CC1=CC=CC=C1)=O)F)C(F)(F)F |