SpectraBase Spectrum ID |
4uizsEGrtU8 |
Name |
Cyclohexanepropanol, 2,2,6-trimethyl-alpha-propyl- |
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/c1-5-7-13(16)9-10-14-12(2)8-6-11-15(14,3)4/h12-14,16H,5-11H2,1-4H3 |
InChIKey |
BVDMQAQCEBGIJR-UHFFFAOYSA-N |
Molecular Weight |
226.404 g/mol |
SMILES |
OC(CCC1C(CCCC1C)(C)C)CCC |
Spectrum/Structure Validation Score (Raman) |
0.983683 |