| SpectraBase Compound ID | 2ISowK16iWa |
|---|---|
| InChI | InChI=1S/C17H26BrNO/c1-3-5-6-7-8-11-14-19(4-2)17(20)15-12-9-10-13-16(15)18/h9-10,12-13H,3-8,11,14H2,1-2H3 |
| InChIKey | XKNXAFQWUBCYIH-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 | HlYPv3X7vPZ |
|---|---|
| Name | Benzamide, 2-bromo-N-ethyl-N-octyl- |
| 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/c1-3-5-6-7-8-11-14-19(4-2)17(20)15-12-9-10-13-16(15)18/h9-10,12-13H,3-8,11,14H2,1-2H3 |
| InChIKey | XKNXAFQWUBCYIH-UHFFFAOYSA-N |
| Molecular Weight | 340.305 g/mol |
| SMILES | C1=C(C(=CC=C1)C(N(CC)CCCCCCCC)=O)Br |