SpectraBase Compound ID | IVZtcJ5xXpc |
---|---|
InChI | InChI=1S/C10H20O2/c11-8-4-3-6-9-5-1-2-7-10(9)12/h9-12H,1-8H2 |
InChIKey | TYROSEUBWLWQFP-UHFFFAOYSA-N |
Mol Weight | 172.27 g/mol |
Molecular Formula | C10H20O2 |
Exact Mass | 172.14633 g/mol |
SpectraBase Spectrum ID | 1u9Q6twGgaY |
---|---|
Name | 2-(4-Hydroxybutyl)cyclohexanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 172.146329882 u |
Formula | C10H20O2 |
InChI | InChI=1S/C10H20O2/c11-8-4-3-6-9-5-1-2-7-10(9)12/h9-12H,1-8H2 |
InChIKey | TYROSEUBWLWQFP-UHFFFAOYSA-N |
Molecular Weight | 172.268 g/mol |
SMILES | C1CCCC(C1O)CCCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.868393 |