| SpectraBase Compound ID | 4RUbtswWlku |
|---|---|
| InChI | InChI=1S/C15H30O/c1-3-5-7-8-9-11-13-15-14(16-15)12-10-6-4-2/h14-15H,3-13H2,1-2H3/t14-,15+/m1/s1 |
| InChIKey | XNYGWIBWMUHLKU-CABCVRRESA-N |
| Mol Weight | 226.4 g/mol |
| Molecular Formula | C15H30O |
| Exact Mass | 226.229666 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 | 15nNwxWA8I3 |
|---|---|
| Name | Oxirane, 2-octyl-3-pentyl-, (2S-cis)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.229665585 u |
| Formula | C15H30O |
| InChI | InChI=1S/C15H30O/c1-3-5-7-8-9-11-13-15-14(16-15)12-10-6-4-2/h14-15H,3-13H2,1-2H3/t14-,15+/m1/s1 |
| InChIKey | XNYGWIBWMUHLKU-CABCVRRESA-N |
| Molecular Weight | 226.404 g/mol |
| SMILES | [C@@]1(O[C@@]1(CCCCC)[H])(CCCCCCCC)[H] |