| SpectraBase Compound ID | DvfOZDEEPGn |
|---|---|
| InChI | InChI=1S/C20H24BrNO/c1-2-3-4-8-14-22(16-17-10-6-5-7-11-17)20(23)18-12-9-13-19(21)15-18/h5-7,9-13,15H,2-4,8,14,16H2,1H3 |
| InChIKey | KWQULGLGBGOJIS-UHFFFAOYSA-N |
| Mol Weight | 374.32 g/mol |
| Molecular Formula | C20H24BrNO |
| Exact Mass | 373.104127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GHWL1XNGgGH |
|---|---|
| Name | Benzamide, 3-bromo-N-benzyl-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.104127396 u |
| Formula | C20H24BrNO |
| InChI | InChI=1S/C20H24BrNO/c1-2-3-4-8-14-22(16-17-10-6-5-7-11-17)20(23)18-12-9-13-19(21)15-18/h5-7,9-13,15H,2-4,8,14,16H2,1H3 |
| InChIKey | KWQULGLGBGOJIS-UHFFFAOYSA-N |
| Molecular Weight | 374.322 g/mol |
| SMILES | C(N(CCCCCC)CC1=CC=CC=C1)(=O)C=1C=C(C=CC1)Br |