| SpectraBase Compound ID | 9X1r8fzXEqj |
|---|---|
| InChI | InChI=1S/C14H9BrF3NO/c15-11-3-1-2-4-12(11)19-13(20)9-5-7-10(8-6-9)14(16,17)18/h1-8H,(H,19,20) |
| InChIKey | NLBBFOBACIUAMA-UHFFFAOYSA-N |
| Mol Weight | 344.13 g/mol |
| Molecular Formula | C14H9BrF3NO |
| Exact Mass | 342.981961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 590QlXW27F5 |
|---|---|
| Name | Benzamide, 4-trifluoromethyl-N-(2-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.981961402 u |
| Formula | C14H9BrF3NO |
| InChI | InChI=1S/C14H9BrF3NO/c15-11-3-1-2-4-12(11)19-13(20)9-5-7-10(8-6-9)14(16,17)18/h1-8H,(H,19,20) |
| InChIKey | NLBBFOBACIUAMA-UHFFFAOYSA-N |
| Molecular Weight | 344.131 g/mol |
| SMILES | C1(=CC=C(C=C1)C(F)(F)F)C(NC1=CC=CC=C1Br)=O |