| SpectraBase Compound ID | B5Jbxkes01L |
|---|---|
| InChI | InChI=1S/C16H21F4NO/c1-2-3-4-5-6-7-8-21-15(22)12-9-13(16(18,19)20)11-14(17)10-12/h9-11H,2-8H2,1H3,(H,21,22) |
| InChIKey | XZSICMYEABXNNI-UHFFFAOYSA-N |
| Mol Weight | 319.34 g/mol |
| Molecular Formula | C16H21F4NO |
| Exact Mass | 319.155927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KvymEHkzWXF |
|---|---|
| Name | Benzamide, 3-fluoro-5-trifluoromethyl-N-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/c1-2-3-4-5-6-7-8-21-15(22)12-9-13(16(18,19)20)11-14(17)10-12/h9-11H,2-8H2,1H3,(H,21,22) |
| InChIKey | XZSICMYEABXNNI-UHFFFAOYSA-N |
| Molecular Weight | 319.344 g/mol |
| SMILES | C(NCCCCCCCC)(=O)C=1C=C(C=C(F)C1)C(F)(F)F |