| SpectraBase Compound ID | Co8ZBy3brFz |
|---|---|
| InChI | InChI=1S/C27H54BrNO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-24-29(25(4)22-7-3)27(30)26(28)23-9-6-2/h25-26H,5-24H2,1-4H3 |
| InChIKey | WOCOFKLMRXHGKP-UHFFFAOYSA-N |
| Mol Weight | 488.6 g/mol |
| Molecular Formula | C27H54BrNO |
| Exact Mass | 487.338878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HMxkHlBfWVh |
|---|---|
| Name | Hexanamide, 2-bromo-N-(2-pentyl)-N-hexadecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 487.338878362 u |
| Formula | C27H54BrNO |
| InChI | InChI=1S/C27H54BrNO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-24-29(25(4)22-7-3)27(30)26(28)23-9-6-2/h25-26H,5-24H2,1-4H3 |
| InChIKey | WOCOFKLMRXHGKP-UHFFFAOYSA-N |
| Molecular Weight | 488.639 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C(CCCC)Br)CCCCCCCCCCCCCCC |