| SpectraBase Spectrum ID |
DCo2uyPXbkh |
| Name |
(1R,3ar,5E,9E,11R,12Ar)-1-isopropyl-3A,6,10-trimethyl-2,3,4,7,8,11,12,12A-octahydrocyclopentacycloundecene-1,11-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.255880333 u |
| Formula |
C20H34O2 |
| InChI |
InChI=1S/C20H34O2/c1-14(2)20(22)12-11-19(5)10-9-15(3)7-6-8-16(4)17(21)13-18(19)20/h8-9,14,17-18,21-22H,6-7,10-13H2,1-5H3/b15-9+,16-8+/t17-,18-,19+,20-/m1/s1 |
| InChIKey |
VVZAWRAWPMNAAR-DKBGJDPMSA-N |
| SMILES |
[C@]12([C@@](CC[C@@]2(C\C=C\(CC\C=C\([C@@](C1)(O)[H])C)C)C)(C(C)C)O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810969 |
