| SpectraBase Compound ID | 3dCYGVw7jfe |
|---|---|
| InChI | InChI=1S/C20H31F2NO/c1-3-5-7-8-9-10-11-15-23(14-6-4-2)20(24)17-12-13-18(21)19(22)16-17/h12-13,16H,3-11,14-15H2,1-2H3 |
| InChIKey | WSWVANCUDMJBQU-UHFFFAOYSA-N |
| Mol Weight | 339.47 g/mol |
| Molecular Formula | C20H31F2NO |
| Exact Mass | 339.237371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KM4OZcqbpXR |
|---|---|
| Name | Benzamide, 3,4-difluoro-N-butyl-N-nonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.237370947 u |
| Formula | C20H31F2NO |
| InChI | InChI=1S/C20H31F2NO/c1-3-5-7-8-9-10-11-15-23(14-6-4-2)20(24)17-12-13-18(21)19(22)16-17/h12-13,16H,3-11,14-15H2,1-2H3 |
| InChIKey | WSWVANCUDMJBQU-UHFFFAOYSA-N |
| Molecular Weight | 339.471 g/mol |
| SMILES | C1(=CC=C(C=C1F)C(N(CCCCCCCCC)CCCC)=O)F |