SpectraBase Spectrum ID |
6hqWPUIqYB |
Name |
3,3,5-Trimethyl-7-methylene-9-oxabicyclo[3.3.1]nonan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
196.146329882 u |
Formula |
C12H20O2 |
InChI |
InChI=1S/C12H20O2/c1-9-5-11(4)7-10(2,3)8-12(13,6-9)14-11/h13H,1,5-8H2,2-4H3 |
InChIKey |
KPIKHFBRAQIEDE-UHFFFAOYSA-N |
Molecular Weight |
196.290 g/mol |
SMILES |
C12(OC(C)(CC(C2)(C)C)CC(C1)=C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94729 |