| SpectraBase Compound ID | JBixodz6KCT |
|---|---|
| InChI | InChI=1S/C24H40BrNO/c1-4-6-7-8-9-10-11-12-13-14-20-26(21(3)15-5-2)24(27)22-16-18-23(25)19-17-22/h16-19,21H,4-15,20H2,1-3H3 |
| InChIKey | WJMMLDQQRCQWJH-UHFFFAOYSA-N |
| Mol Weight | 438.5 g/mol |
| Molecular Formula | C24H40BrNO |
| Exact Mass | 437.229328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AdxpXnL54Hc |
|---|---|
| Name | Benzamide, 4-bromo-N-(2-pentyl)-N-dodecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 437.229327911 u |
| Formula | C24H40BrNO |
| InChI | InChI=1S/C24H40BrNO/c1-4-6-7-8-9-10-11-12-13-14-20-26(21(3)15-5-2)24(27)22-16-18-23(25)19-17-22/h16-19,21H,4-15,20H2,1-3H3 |
| InChIKey | WJMMLDQQRCQWJH-UHFFFAOYSA-N |
| Molecular Weight | 438.494 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C=1C=CC(=CC1)Br)CCCCCCCCCCC |