SpectraBase Spectrum ID |
5lBzAIz3Kjc |
Name |
10,17,17-Trimethylgona-5,13-dien-3-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
286.229665585 u |
Formula |
C20H30O |
InChI |
InChI=1S/C20H30O/c1-19(2)10-9-16-15-5-4-13-12-14(21)8-11-20(13,3)18(15)7-6-17(16)19/h4,14-15,18,21H,5-12H2,1-3H3 |
InChIKey |
WUVNCYQZZPBIBS-UHFFFAOYSA-N |
SMILES |
C=1CC2C3=C(C(C)(C)CC3)CCC2C2(C1CC(O)CC2)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836504 |