| SpectraBase Compound ID | 5FWg56XVo2j |
|---|---|
| InChI | InChI=1S/C18H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-15-21-18(14-19)16-20-17/h17-18H,2-13,15-16H2,1H3 |
| InChIKey | WROKCLFQSVGZRB-UHFFFAOYSA-N |
| Mol Weight | 295.5 g/mol |
| Molecular Formula | C18H33NO2 |
| Exact Mass | 295.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7zsXiE8CUR2 |
|---|---|
| Name | 2-Cyano-5-tridecyl-1,4-dioxane |
| 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/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-15-21-18(14-19)16-20-17/h17-18H,2-13,15-16H2,1H3 |
| InChIKey | WROKCLFQSVGZRB-UHFFFAOYSA-N |
| Molecular Weight | 295.467 g/mol |
| SMILES | C(#N)C1OCC(OC1)CCCCCCCCCCCCC |