SpectraBase Spectrum ID |
5suck5tmNvf |
Name |
(8rs)-8-Hydroxy-5,7,7-trimethylbicyclo[3.3.0]octan-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
182.130679818 u |
Formula |
C11H18O2 |
InChI |
InChI=1S/C11H18O2/c1-10(2)6-11(3)5-4-7(12)8(11)9(10)13/h8-9,13H,4-6H2,1-3H3 |
InChIKey |
SBQKDHNDKIGIQW-UHFFFAOYSA-N |
Molecular Weight |
182.263 g/mol |
SMILES |
C12C(CCC2(CC(C1O)(C)C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955628 |