| SpectraBase Spectrum ID |
5vSgIIaiAvc |
| Name |
(4ar*,5S*,7as*)-2,2,4A-Trimethyl-6-(propan-2-ylidene)hexahydro-2H-cyclopenta[D]-[1,3]dioxin-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/c1-8(2)9-6-10-13(5,11(9)14)7-15-12(3,4)16-10/h10-11,14H,6-7H2,1-5H3/t10-,11-,13-/m0/s1 |
| InChIKey |
AZEUAOPNMCYDJF-GVXVVHGQSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C1(C)(O[C@]2(CC([C@@]([C@@]2(C)CO1)(O)[H])=C(C)C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982944 |
![(4aR*,5S*,7aS*)-2,2,4a-Trimethyl-6-(propan-2-ylidene)hexahydro-2H-cyclopenta[d]-[1,3]dioxin-5-ol](/api/spectrum/5vSgIIaiAvc/structure.png?h=300&w=458 "(4aR*,5S*,7aS*)-2,2,4a-Trimethyl-6-(propan-2-ylidene)hexahydro-2H-cyclopenta[d]-[1,3]dioxin-5-ol")
