| SpectraBase Compound ID | B0ZKrjzLu6D |
|---|---|
| InChI | InChI=1S/C22H44BrNO/c1-5-8-10-11-12-13-14-15-16-19-24(20(4)17-7-3)22(25)21(23)18-9-6-2/h20-21H,5-19H2,1-4H3 |
| InChIKey | VCQHDLYQVCECKK-UHFFFAOYSA-N |
| Mol Weight | 418.5 g/mol |
| Molecular Formula | C22H44BrNO |
| Exact Mass | 417.260628 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4KFNfBm8FqT |
|---|---|
| Name | Hexanamide, 2-bromo-N-(2-pentyl)-N-undecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 417.260628040 u |
| Formula | C22H44BrNO |
| InChI | InChI=1S/C22H44BrNO/c1-5-8-10-11-12-13-14-15-16-19-24(20(4)17-7-3)22(25)21(23)18-9-6-2/h20-21H,5-19H2,1-4H3 |
| InChIKey | VCQHDLYQVCECKK-UHFFFAOYSA-N |
| Molecular Weight | 418.504 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C(CCCC)Br)CCCCCCCCCC |