SpectraBase Spectrum ID |
7CUtFHJyAMn |
Name |
(1R,4ar,4bs,10Ar)-7-isopropyl-1,4A-dimethyl-1,2,3,4,4A,4B,5,9,10,10A-decahydrophenanthrene-1-carbaldehyde |
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/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,12-14,17-18H,5,7-11H2,1-4H3 |
InChIKey |
QAOPEXQKBQUUSQ-UHFFFAOYSA-N |
SMILES |
C1C2C(=CC(=C1)C(C)C)CCC1C2(CCCC1(C=O)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836829 |