| SpectraBase Compound ID | HSOkokGdaHe |
|---|---|
| InChI | InChI=1S/C18H33NO2/c1-5-8-10-11-12-13-15-19(17(4)14-7-3)18(20)21-16-9-6-2/h2,17H,5,7-16H2,1,3-4H3 |
| InChIKey | BYFFTRAGEDDEHP-UHFFFAOYSA-N |
| Mol Weight | 295.5 g/mol |
| Molecular Formula | C18H33NO2 |
| Exact Mass | 295.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6WcKlKy6LCm |
|---|---|
| Name | Carbonic acid, monoamide, N-(2-pentyl)-N-octyl-, but-3-yn-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.251129305 u |
| Formula | C18H33NO2 |
| InChI | InChI=1S/C18H33NO2/c1-5-8-10-11-12-13-15-19(17(4)14-7-3)18(20)21-16-9-6-2/h2,17H,5,7-16H2,1,3-4H3 |
| InChIKey | BYFFTRAGEDDEHP-UHFFFAOYSA-N |
| Molecular Weight | 295.467 g/mol |
| SMILES | CCCC(C)N(C(OCCC#C)=O)CCCCCCCC |