| SpectraBase Compound ID | 43MmH8EDrnQ |
|---|---|
| InChI | InChI=1S/C21H33F2NO/c1-3-5-6-7-8-9-10-11-12-16-24(15-4-2)21(25)19-14-13-18(22)17-20(19)23/h13-14,17H,3-12,15-16H2,1-2H3 |
| InChIKey | DQVSJEPFUACPKN-UHFFFAOYSA-N |
| Mol Weight | 353.5 g/mol |
| Molecular Formula | C21H33F2NO |
| Exact Mass | 353.253021 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8d0kBJFH7O9 |
|---|---|
| Name | Benzamide, 2,4-difluoro-N-propyl-N-undecyl- |
| 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/c1-3-5-6-7-8-9-10-11-12-16-24(15-4-2)21(25)19-14-13-18(22)17-20(19)23/h13-14,17H,3-12,15-16H2,1-2H3 |
| InChIKey | DQVSJEPFUACPKN-UHFFFAOYSA-N |
| Molecular Weight | 353.498 g/mol |
| SMILES | C(N(CCC)CCCCCCCCCCC)(=O)C=1C=CC(=CC1F)F |