| SpectraBase Compound ID | JYEQZGBRdOI |
|---|---|
| InChI | InChI=1S/C17H26BrNO/c1-4-6-7-8-12-19(14(3)5-2)17(20)15-10-9-11-16(18)13-15/h9-11,13-14H,4-8,12H2,1-3H3 |
| InChIKey | MKKIQWYEVKGTPN-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 | EjfnsXh0ZAR |
|---|---|
| Name | Benzamide, 3-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/c1-4-6-7-8-12-19(14(3)5-2)17(20)15-10-9-11-16(18)13-15/h9-11,13-14H,4-8,12H2,1-3H3 |
| InChIKey | MKKIQWYEVKGTPN-UHFFFAOYSA-N |
| Molecular Weight | 340.305 g/mol |
| SMILES | C1=CC=C(C=C1C(N(CCCCCC)C(CC)C)=O)Br |