| SpectraBase Compound ID | 1O0S67IXCUA |
|---|---|
| InChI | InChI=1S/C17H23F4NO/c1-3-5-6-7-11-22(10-4-2)16(23)14-12-13(17(19,20)21)8-9-15(14)18/h8-9,12H,3-7,10-11H2,1-2H3 |
| InChIKey | VWDUSNWUSJTNDC-UHFFFAOYSA-N |
| Mol Weight | 333.37 g/mol |
| Molecular Formula | C17H23F4NO |
| Exact Mass | 333.171577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1eaayksRo8M |
|---|---|
| Name | Benzamide, 2-fluoro-5-trifluoromethyl-N-propyl-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.171577016 u |
| Formula | C17H23F4NO |
| InChI | InChI=1S/C17H23F4NO/c1-3-5-6-7-11-22(10-4-2)16(23)14-12-13(17(19,20)21)8-9-15(14)18/h8-9,12H,3-7,10-11H2,1-2H3 |
| InChIKey | VWDUSNWUSJTNDC-UHFFFAOYSA-N |
| Molecular Weight | 333.371 g/mol |
| SMILES | C(N(CCC)CCCCCC)(=O)C=1C(F)=CC=C(C(F)(F)F)C1 |