| SpectraBase Compound ID | 94gEHs7iDZv |
|---|---|
| InChI | InChI=1S/C27H55NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28-26(29)23-25(2)24-27(3,4)5/h25H,6-24H2,1-5H3,(H,28,29) |
| InChIKey | NGRGUNIQTDRNHU-UHFFFAOYSA-N |
| Mol Weight | 409.7 g/mol |
| Molecular Formula | C27H55NO |
| Exact Mass | 409.428365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9w3UxheVvM1 |
|---|---|
| Name | Hexanamide, 3,5,5-trimethyl-N-octadecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 409.428365394 u |
| Formula | C27H55NO |
| InChI | InChI=1S/C27H55NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28-26(29)23-25(2)24-27(3,4)5/h25H,6-24H2,1-5H3,(H,28,29) |
| InChIKey | NGRGUNIQTDRNHU-UHFFFAOYSA-N |
| Molecular Weight | 409.743 g/mol |
| SMILES | C(=O)(NCCCCCCCCCCCCCCCCCC)CC(CC(C)(C)C)C |