| SpectraBase Compound ID | 1sVVynkgEry |
|---|---|
| InChI | InChI=1S/C17H22F5NO/c1-4-6-7-8-10(3)23(9-5-2)17(24)11-12(18)14(20)16(22)15(21)13(11)19/h10H,4-9H2,1-3H3 |
| InChIKey | XHUOCIDOKRKBPC-UHFFFAOYSA-N |
| Mol Weight | 351.36 g/mol |
| Molecular Formula | C17H22F5NO |
| Exact Mass | 351.162155 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DJFJuLS1ait |
|---|---|
| Name | Benzamide, pentafluoro-N-propyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.162155146 u |
| Formula | C17H22F5NO |
| InChI | InChI=1S/C17H22F5NO/c1-4-6-7-8-10(3)23(9-5-2)17(24)11-12(18)14(20)16(22)15(21)13(11)19/h10H,4-9H2,1-3H3 |
| InChIKey | XHUOCIDOKRKBPC-UHFFFAOYSA-N |
| Molecular Weight | 351.361 g/mol |
| SMILES | C(N(CCC)C(CCCCC)C)(=O)C=1C(F)=C(C(=C(F)C1F)F)F |