| SpectraBase Compound ID | 8V0CpXaaLEK |
|---|---|
| InChI | InChI=1S/C17H23F4NO/c1-3-5-6-7-12-22(11-4-2)16(23)13-9-8-10-14(15(13)18)17(19,20)21/h8-10H,3-7,11-12H2,1-2H3 |
| InChIKey | NALGLPDRIOLFGC-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 | 153RGwGqf6Z |
|---|---|
| Name | Benzamide, 2-fluoro-3-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/c1-3-5-6-7-12-22(11-4-2)16(23)13-9-8-10-14(15(13)18)17(19,20)21/h8-10H,3-7,11-12H2,1-2H3 |
| InChIKey | NALGLPDRIOLFGC-UHFFFAOYSA-N |
| Molecular Weight | 333.371 g/mol |
| SMILES | C(N(CCC)CCCCCC)(=O)C=1C=CC=C(C(F)(F)F)C1F |