| SpectraBase Compound ID | LCdriWGGSzf |
|---|---|
| InChI | InChI=1S/C23H38BrNO/c1-4-6-7-8-9-10-11-12-13-16-19-25(20(3)5-2)23(26)21-17-14-15-18-22(21)24/h14-15,17-18,20H,4-13,16,19H2,1-3H3 |
| InChIKey | MCHVDKZXRIYMBD-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 | Dre9z43KhyL |
|---|---|
| Name | Benzamide, 2-bromo-N-(2-butyl)-N-dodecyl- |
| 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/c1-4-6-7-8-9-10-11-12-13-16-19-25(20(3)5-2)23(26)21-17-14-15-18-22(21)24/h14-15,17-18,20H,4-13,16,19H2,1-3H3 |
| InChIKey | MCHVDKZXRIYMBD-UHFFFAOYSA-N |
| Molecular Weight | 424.467 g/mol |
| SMILES | C(=O)(N(CCCCCCCCCCCC)C(CC)C)C=1C(Br)=CC=CC1 |