| SpectraBase Compound ID | IkQljaB01Pl |
|---|---|
| InChI | InChI=1S/C21H43NO2/c1-5-8-10-12-14-16-19-24-21(23)22(20(4)17-7-3)18-15-13-11-9-6-2/h20H,5-19H2,1-4H3 |
| InChIKey | PKESSUQNAAAZMR-UHFFFAOYSA-N |
| Mol Weight | 341.6 g/mol |
| Molecular Formula | C21H43NO2 |
| Exact Mass | 341.32938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6iZadNsWHut |
|---|---|
| Name | Carbonic acid, monoamide, N-(2-pentyl)-N-heptyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.329379627 u |
| Formula | C21H43NO2 |
| InChI | InChI=1S/C21H43NO2/c1-5-8-10-12-14-16-19-24-21(23)22(20(4)17-7-3)18-15-13-11-9-6-2/h20H,5-19H2,1-4H3 |
| InChIKey | PKESSUQNAAAZMR-UHFFFAOYSA-N |
| Molecular Weight | 341.580 g/mol |
| SMILES | CCCC(C)N(C(OCCCCCCCC)=O)CCCCCCC |