| SpectraBase Spectrum ID |
K9CxTEL06r0 |
| Name |
(2.alpha.,4A.beta.,8.alpha.,8A.alpha.)-Decahydro-2,8A-dimethyl-2,8-naphthalendiol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
198.161979946 u |
| Formula |
C12H22O2 |
| InChI |
InChI=1S/C12H22O2/c1-11(14)7-6-9-4-3-5-10(13)12(9,2)8-11/h9-10,13-14H,3-8H2,1-2H3/t9-,10-,11+,12-/m0/s1 |
| InChIKey |
ISMFVAUGZVIVDR-YFKTTZPYSA-N |
| Molecular Weight |
198.306 g/mol |
| SMILES |
[C@]12(C[C@@](O)(C)CC[C@@]2(CCC[C@@]1(O)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933226 |
