SpectraBase Spectrum ID |
2frF6sEtCXC |
Name |
(1R,2S,8R,8ar)-8-Acetoxy-1-(2-hydroxyethyl)-1,2,5,5-tetramethyl-trans-decalin |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.235144887 u |
Formula |
C18H32O3 |
InChI |
InChI=1S/C18H32O3/c1-12-6-7-14-16(18(12,5)10-11-19)15(21-13(2)20)8-9-17(14,3)4/h12,14-16,19H,6-11H2,1-5H3 |
InChIKey |
ZAWLLCGKYOTVIL-UHFFFAOYSA-N |
SMILES |
C1CC(C)(C2C(C1OC(C)=O)C(C(C)CC2)(CCO)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816077 |