| SpectraBase Compound ID | Gf23sXWwBOO |
|---|---|
| InChI | InChI=1S/C23H38BrNO/c1-3-5-7-9-11-13-18-25(19-14-12-10-8-6-4-2)23(26)21-16-15-17-22(24)20-21/h15-17,20H,3-14,18-19H2,1-2H3 |
| InChIKey | LBOYEDQYTMLKPI-UHFFFAOYSA-N |
| Mol Weight | 424.5 g/mol |
| Molecular Formula | C23H38BrNO |
| Exact Mass | 423.213678 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2PlWaPHvfRp |
|---|---|
| Name | Benzamide, N,N-dioctyl-3-bromo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 423.213677847 u |
| Formula | C23H38BrNO |
| InChI | InChI=1S/C23H38BrNO/c1-3-5-7-9-11-13-18-25(19-14-12-10-8-6-4-2)23(26)21-16-15-17-22(24)20-21/h15-17,20H,3-14,18-19H2,1-2H3 |
| InChIKey | LBOYEDQYTMLKPI-UHFFFAOYSA-N |
| Molecular Weight | 424.467 g/mol |
| SMILES | C1(=CC=CC(=C1)C(N(CCCCCCCC)CCCCCCCC)=O)Br |