SpectraBase Spectrum ID |
Ay8EyKIiRoP |
Name |
6-Ethyl-2,5-dimethyl-5-(prop-1-en-2-yl)octan-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
226.229665585 u |
Formula |
C15H30O |
InChI |
InChI=1S/C15H30O/c1-8-13(9-2)15(7,12(3)4)11-10-14(5,6)16/h13,16H,3,8-11H2,1-2,4-7H3 |
InChIKey |
UGBIMGLTRVRJLD-UHFFFAOYSA-N |
Molecular Weight |
226.404 g/mol |
SMILES |
CC(CCC(C)(C(CC)CC)C(=C)C)(O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899885 |