| SpectraBase Compound ID | JP39YZ9q8pH |
|---|---|
| InChI | InChI=1S/C16H21F4NO/c1-3-4-5-6-7-11(2)21-15(22)12-8-13(16(18,19)20)10-14(17)9-12/h8-11H,3-7H2,1-2H3,(H,21,22) |
| InChIKey | LYOYSPFOFCUKIO-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 | 7AvfszigOEe |
|---|---|
| Name | 3-Fluoro-5-trifluoromethylbenzamide, N-(2-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/c1-3-4-5-6-7-11(2)21-15(22)12-8-13(16(18,19)20)10-14(17)9-12/h8-11H,3-7H2,1-2H3,(H,21,22) |
| InChIKey | LYOYSPFOFCUKIO-UHFFFAOYSA-N |
| Molecular Weight | 319.344 g/mol |
| SMILES | C(C1=CC(=CC(=C1)F)C(F)(F)F)(=O)NC(CCCCCC)C |