| SpectraBase Compound ID | Cas8FlTPqj |
|---|---|
| InChI | InChI=1S/C21H33F2NO/c1-3-5-7-9-11-16-24(17-12-10-8-6-4-2)21(25)20-18(22)14-13-15-19(20)23/h13-15H,3-12,16-17H2,1-2H3 |
| InChIKey | TVSMWNGIRQEUPY-UHFFFAOYSA-N |
| Mol Weight | 353.5 g/mol |
| Molecular Formula | C21H33F2NO |
| Exact Mass | 353.253021 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 | BmyR2Eor1tk |
|---|---|
| Name | Benzamide, N,N-diheptyl-2,6-difluoro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.253021012 u |
| Formula | C21H33F2NO |
| InChI | InChI=1S/C21H33F2NO/c1-3-5-7-9-11-16-24(17-12-10-8-6-4-2)21(25)20-18(22)14-13-15-19(20)23/h13-15H,3-12,16-17H2,1-2H3 |
| InChIKey | TVSMWNGIRQEUPY-UHFFFAOYSA-N |
| Molecular Weight | 353.498 g/mol |
| SMILES | C1=CC=C(C(=C1F)C(N(CCCCCCC)CCCCCCC)=O)F |