| SpectraBase Compound ID | B23bTdY0ET9 |
|---|---|
| InChI | InChI=1S/C17H23F4NO/c1-3-5-7-12-22(11-6-4-2)16(23)13-9-8-10-14(15(13)18)17(19,20)21/h8-10H,3-7,11-12H2,1-2H3 |
| InChIKey | QLMRJELCFMANJF-UHFFFAOYSA-N |
| Mol Weight | 333.37 g/mol |
| Molecular Formula | C17H23F4NO |
| Exact Mass | 333.171577 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 | 5xwckuvJLHD |
|---|---|
| Name | Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-butyl- |
| 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/c1-3-5-7-12-22(11-6-4-2)16(23)13-9-8-10-14(15(13)18)17(19,20)21/h8-10H,3-7,11-12H2,1-2H3 |
| InChIKey | QLMRJELCFMANJF-UHFFFAOYSA-N |
| Molecular Weight | 333.371 g/mol |
| SMILES | C1=CC=C(C(=C1C(=O)N(CCCCC)CCCC)F)C(F)(F)F |