| SpectraBase Spectrum ID |
6r4JDqQCv39 |
| Name |
3'-Tert-butyl-6'-isopropyl-6-(2,2-dimethylpropyl)spiro[dioxalane-2,1'-cyclohexane] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.302830526 u |
| Formula |
C21H40O2 |
| InChI |
InChI=1S/C21H40O2/c1-15(2)18-10-9-16(20(6,7)8)13-21(18)22-12-11-17(23-21)14-19(3,4)5/h15-18H,9-14H2,1-8H3 |
| InChIKey |
WKYBQEQNNVBAJT-UHFFFAOYSA-N |
| Molecular Weight |
324.549 g/mol |
| SMILES |
C12(OC(CC(C)(C)C)CCO2)C(CCC(C1)C(C)(C)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950283 |
![3'-Tert-butyl-6'-isopropyl-6-(2,2-dimethylpropyl)spiro[dioxalane-2,1'-cyclohexane]](/api/spectrum/6r4JDqQCv39/structure.png?h=300&w=458 "3'-Tert-butyl-6'-isopropyl-6-(2,2-dimethylpropyl)spiro[dioxalane-2,1'-cyclohexane]")
