| SpectraBase Compound ID | ChM3oi58kib |
|---|---|
| InChI | InChI=1S/C17H26BrNO/c1-4-6-7-8-13-19(14(3)5-2)17(20)15-9-11-16(18)12-10-15/h9-12,14H,4-8,13H2,1-3H3 |
| InChIKey | SIGSSDMKNYZTNX-UHFFFAOYSA-N |
| Mol Weight | 340.31 g/mol |
| Molecular Formula | C17H26BrNO |
| Exact Mass | 339.119777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 99X5qd8XjyB |
|---|---|
| Name | Benzamide, 4-bromo-N-(2-butyl)-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.119777460 u |
| Formula | C17H26BrNO |
| InChI | InChI=1S/C17H26BrNO/c1-4-6-7-8-13-19(14(3)5-2)17(20)15-9-11-16(18)12-10-15/h9-12,14H,4-8,13H2,1-3H3 |
| InChIKey | SIGSSDMKNYZTNX-UHFFFAOYSA-N |
| Molecular Weight | 340.305 g/mol |
| SMILES | C(=O)(N(CCCCCC)C(CC)C)C=1C=CC(=CC1)Br |