SpectraBase Spectrum ID |
HD0NOoZc6nN |
Name |
(3ar,4S,8R,8as)-3A,6,8,8A-Tetrahydro-2,2,4,6,6-pentamethyl-4,8-ethano-6H-indeno[5,6-D]-1,3-dioxole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
258.161979946 u |
Formula |
C17H22O2 |
InChI |
InChI=1S/C17H22O2/c1-15(2)8-11-10-6-7-17(5,12(11)9-15)14-13(10)18-16(3,4)19-14/h6-10,13-14H,1-5H3/t10-,13+,14+,17-/m1/s1 |
InChIKey |
ZOENUUUWNDDOHP-GRHWWUNPSA-N |
Molecular Weight |
258.361 g/mol |
SMILES |
C=12C([C@@]3([C@]4([C@@]([C@@]2(C=C3)C)(OC(C)(C)O4)[H])[H])[H])=CC(C1)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898249 |