| SpectraBase Compound ID | 9NLFQui3vc0 |
|---|---|
| InChI | InChI=1S/C14H9ClF3NO/c15-11-4-6-12(7-5-11)19-13(20)9-2-1-3-10(8-9)14(16,17)18/h1-8H,(H,19,20) |
| InChIKey | IEWWTKVYWQMDQW-UHFFFAOYSA-N |
| Mol Weight | 299.68 g/mol |
| Molecular Formula | C14H9ClF3NO |
| Exact Mass | 299.032476 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3JP44nVeSR |
|---|---|
| Name | Benzamide, 3-trifluoromethyl-N-(4-chlorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.032476102 u |
| Formula | C14H9ClF3NO |
| InChI | InChI=1S/C14H9ClF3NO/c15-11-4-6-12(7-5-11)19-13(20)9-2-1-3-10(8-9)14(16,17)18/h1-8H,(H,19,20) |
| InChIKey | IEWWTKVYWQMDQW-UHFFFAOYSA-N |
| Molecular Weight | 299.680 g/mol |
| SMILES | C1=CC=C(C=C1C(=O)NC1=CC=C(C=C1)Cl)C(F)(F)F |