SpectraBase Spectrum ID |
51EE3dxKwcd |
Name |
(1S,4R,4ar,8as)-1-(1,5-Dimethyl-hex-4-enyl)-4,7-dimethyl-1,3,4,5,6,8A-hexahydro-2H-naphthalen-4A-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.260965714 u |
Formula |
C20H34O |
InChI |
InChI=1S/C20H34O/c1-14(2)7-6-8-16(4)18-10-9-17(5)20(21)12-11-15(3)13-19(18)20/h7,13,16-19,21H,6,8-12H2,1-5H3/t16?,17-,18+,19-,20-/m1/s1 |
InChIKey |
JRNAGAYIOYMILR-DGDSNLKDSA-N |
SMILES |
[C@@]12([C@@](CCC(=C2)C)([C@](C)(CC[C@]1(C(CCC=C(C)C)C)[H])[H])O)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932502 |