| SpectraBase Compound ID | 4keztyYQuBe |
|---|---|
| InChI | InChI=1S/C28H57NO2/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-24-26-29(3)28(30)31-27-25-23-11-9-7-5-2/h4-27H2,1-3H3 |
| InChIKey | NMOKCBHAOLNAOT-UHFFFAOYSA-N |
| Mol Weight | 439.8 g/mol |
| Molecular Formula | C28H57NO2 |
| Exact Mass | 439.43893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5oNNuOx64Kx |
|---|---|
| Name | Carbamic acid, N-methyl-N-octadecyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 439.438930077 u |
| Formula | C28H57NO2 |
| InChI | InChI=1S/C28H57NO2/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-24-26-29(3)28(30)31-27-25-23-11-9-7-5-2/h4-27H2,1-3H3 |
| InChIKey | NMOKCBHAOLNAOT-UHFFFAOYSA-N |
| Molecular Weight | 439.769 g/mol |
| SMILES | C(CN(C(OCCCCCCCC)=O)C)CCCCCCCCCCCCCCCC |