| SpectraBase Compound ID | IxSnjdUSZLP |
|---|---|
| InChI | InChI=1S/C15H18F5NO/c1-2-3-4-5-6-7-8-21-15(22)9-10(16)12(18)14(20)13(19)11(9)17/h2-8H2,1H3,(H,21,22) |
| InChIKey | LUGHWPTZTPSUOE-UHFFFAOYSA-N |
| Mol Weight | 323.31 g/mol |
| Molecular Formula | C15H18F5NO |
| Exact Mass | 323.130855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3SFRwomVz5 |
|---|---|
| Name | Pentafluorobenzamide, N-octyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.130855018 u |
| Formula | C15H18F5NO |
| InChI | InChI=1S/C15H18F5NO/c1-2-3-4-5-6-7-8-21-15(22)9-10(16)12(18)14(20)13(19)11(9)17/h2-8H2,1H3,(H,21,22) |
| InChIKey | LUGHWPTZTPSUOE-UHFFFAOYSA-N |
| Molecular Weight | 323.307 g/mol |
| SMILES | CCCCCCCCNC(C=1C(F)=C(F)C(=C(C1F)F)F)=O |