SpectraBase Spectrum ID |
GvGTqzdqW1D |
Name |
(3ar,4S,4as,7ar,8R,8as)-3A,4A,5,6,7,7A,8,8A-Octahydro-2,2,4,6,6-pentamethyl-4,8-etheno-5H-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 |
262.193280075 u |
Formula |
C17H26O2 |
InChI |
InChI=1S/C17H26O2/c1-15(2)8-11-10-6-7-17(5,12(11)9-15)14-13(10)18-16(3,4)19-14/h6-7,10-14H,8-9H2,1-5H3/t10-,11+,12+,13+,14+,17+/m1/s1 |
InChIKey |
QVBUSYBNQNYJFI-UFRCXNNCSA-N |
Molecular Weight |
262.393 g/mol |
SMILES |
[C@@]12([C@@]3([C@](OC(O3)(C)C)([H])[C@@](C=C1)([H])[C@]1([C@@]2(CC(C)(C)C1)[H])[H])[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97632 |