| SpectraBase Spectrum ID |
ERphPDVtSjB |
| Name |
5-Methyoxy-6-acetyl-1,2,3,4,4A,9,10,10A-octahydro-1,1,4A.beta.-trimethylphenanthrene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.208930140 u |
| Formula |
C20H28O2 |
| InChI |
InChI=1S/C20H28O2/c1-13(21)15-9-7-14-8-10-16-19(2,3)11-6-12-20(16,4)17(14)18(15)22-5/h7,9,16H,6,8,10-12H2,1-5H3/t16?,20-/m0/s1 |
| InChIKey |
YPOYVOCSJYUJPA-FZCLLLDFSA-N |
| SMILES |
[C@]12(C=3C(=C(C(=O)C)C=CC3CCC1C(C)(C)CCC2)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949847 |
