| SpectraBase Compound ID | IRRhFJg7z9e |
|---|---|
| InChI | InChI=1S/C14H28O/c1-2-3-4-5-6-8-11-14(15)12-9-7-10-13-14/h15H,2-13H2,1H3 |
| InChIKey | NYMBQDGBXABZBT-UHFFFAOYSA-N |
| Mol Weight | 212.38 g/mol |
| Molecular Formula | C14H28O |
| Exact Mass | 212.214016 g/mol |
| SpectraBase Spectrum ID | HFAuFVDhc6J |
|---|---|
| Name | Cyclohexanol, 1-octyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.214015521 u |
| Formula | C14H28O |
| InChI | InChI=1S/C14H28O/c1-2-3-4-5-6-8-11-14(15)12-9-7-10-13-14/h15H,2-13H2,1H3 |
| InChIKey | NYMBQDGBXABZBT-UHFFFAOYSA-N |
| Molecular Weight | 212.377 g/mol |
| SMILES | C1(O)(CCCCCCCC)CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.807822 |