| SpectraBase Spectrum ID |
2czASKBWFgE |
| Name |
1-(4-Butylbenzyl)cyclohexanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.198365456 u |
| Formula |
C17H26O |
| InChI |
InChI=1S/C17H26O/c1-2-3-7-15-8-10-16(11-9-15)14-17(18)12-5-4-6-13-17/h8-11,18H,2-7,12-14H2,1H3 |
| InChIKey |
CHXBABBHNWYCSQ-UHFFFAOYSA-N |
| Molecular Weight |
246.394 g/mol |
| SMILES |
C1(CC=2C=CC(=CC2)CCCC)(O)CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.804029 |
