| SpectraBase Compound ID | 4SZZu4oWZnk |
|---|---|
| InChI | InChI=1S/C15H11ClF3NO2/c1-22-13-6-5-11(16)8-12(13)20-14(21)9-3-2-4-10(7-9)15(17,18)19/h2-8H,1H3,(H,20,21) |
| InChIKey | NMLNFTYITLNHJQ-UHFFFAOYSA-N |
| Mol Weight | 329.71 g/mol |
| Molecular Formula | C15H11ClF3NO2 |
| Exact Mass | 329.043041 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4xORWP8W7vi |
|---|---|
| Name | Benzamide, 3-trifluoromethyl-N-(5-chloro-2-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.043040785 u |
| Formula | C15H11ClF3NO2 |
| InChI | InChI=1S/C15H11ClF3NO2/c1-22-13-6-5-11(16)8-12(13)20-14(21)9-3-2-4-10(7-9)15(17,18)19/h2-8H,1H3,(H,20,21) |
| InChIKey | NMLNFTYITLNHJQ-UHFFFAOYSA-N |
| Molecular Weight | 329.706 g/mol |
| SMILES | C1=CC=C(C=C1C(=O)NC1=CC(=CC=C1OC)Cl)C(F)(F)F |