| SpectraBase Compound ID | ATKNRYnz4sW |
|---|---|
| InChI | InChI=1S/C17H25F2NO/c1-3-5-7-8-12-20(11-6-4-2)17(21)15-10-9-14(18)13-16(15)19/h9-10,13H,3-8,11-12H2,1-2H3 |
| InChIKey | CKLMTFPVRZEMCN-UHFFFAOYSA-N |
| Mol Weight | 297.39 g/mol |
| Molecular Formula | C17H25F2NO |
| Exact Mass | 297.190421 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 90LC8A5X4Ii |
|---|---|
| Name | Benzamide, 2,4-difluoro-N-butyl-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.190420754 u |
| Formula | C17H25F2NO |
| InChI | InChI=1S/C17H25F2NO/c1-3-5-7-8-12-20(11-6-4-2)17(21)15-10-9-14(18)13-16(15)19/h9-10,13H,3-8,11-12H2,1-2H3 |
| InChIKey | CKLMTFPVRZEMCN-UHFFFAOYSA-N |
| Molecular Weight | 297.390 g/mol |
| SMILES | C1(=CC=C(C(=C1)F)C(N(CCCCCC)CCCC)=O)F |