| SpectraBase Compound ID | ESYOEqnmPPS |
|---|---|
| InChI | InChI=1S/C16H22F3NO/c1-2-3-4-5-6-7-12-20-15(21)13-8-10-14(11-9-13)16(17,18)19/h8-11H,2-7,12H2,1H3,(H,20,21) |
| InChIKey | SIUIAKWLKXCUAX-UHFFFAOYSA-N |
| Mol Weight | 301.35 g/mol |
| Molecular Formula | C16H22F3NO |
| Exact Mass | 301.165349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Cfht0e3CGC |
|---|---|
| Name | Benzamide, 4-(trifluoromethyl)-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.165348820 u |
| Formula | C16H22F3NO |
| InChI | InChI=1S/C16H22F3NO/c1-2-3-4-5-6-7-12-20-15(21)13-8-10-14(11-9-13)16(17,18)19/h8-11H,2-7,12H2,1H3,(H,20,21) |
| InChIKey | SIUIAKWLKXCUAX-UHFFFAOYSA-N |
| Molecular Weight | 301.353 g/mol |
| SMILES | C(NCCCCCCCC)(=O)C=1C=CC(=CC1)C(F)(F)F |