| SpectraBase Compound ID | ADcx3SL8riY |
|---|---|
| InChI | InChI=1S/C16H21F4NO/c1-2-3-4-5-6-7-10-21-15(22)13-11-12(16(18,19)20)8-9-14(13)17/h8-9,11H,2-7,10H2,1H3,(H,21,22) |
| InChIKey | SFKZJZFOLYAUNF-UHFFFAOYSA-N |
| Mol Weight | 319.34 g/mol |
| Molecular Formula | C16H21F4NO |
| Exact Mass | 319.155927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CkebMRgQiEq |
|---|---|
| Name | Benzamide, 2-fluoro-5-trifluoromethyl-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.155926951 u |
| Formula | C16H21F4NO |
| InChI | InChI=1S/C16H21F4NO/c1-2-3-4-5-6-7-10-21-15(22)13-11-12(16(18,19)20)8-9-14(13)17/h8-9,11H,2-7,10H2,1H3,(H,21,22) |
| InChIKey | SFKZJZFOLYAUNF-UHFFFAOYSA-N |
| Molecular Weight | 319.344 g/mol |
| SMILES | C1=C(C(=CC(=C1)C(F)(F)F)C(NCCCCCCCC)=O)F |