| SpectraBase Spectrum ID |
KgxMHVdgKPe |
| Name |
(5'.alpha.)-Hexahydro-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen-]-5'-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-12(2)7-15-13(16-8-12)5-9-3-11(14)4-10(9)6-13/h9-11,14H,3-8H2,1-2H3 |
| InChIKey |
YZUJXJRMZBEVIL-UHFFFAOYSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C12(OCC(CO2)(C)C)CC2CC(CC2C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942926 |
![(5'.alpha.)-Hexahydro-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen-]-5'-ol](/api/spectrum/KgxMHVdgKPe/structure.png?h=300&w=458 "(5'.alpha.)-Hexahydro-5,5-dimethylspiro[1,3-dioxane-2,2'-(1'H)-pentalen-]-5'-ol")
