| SpectraBase Spectrum ID |
3NcdXhqxRf7 |
| Name |
Delta-8(9)-pimaradien-(13-alpha-methyl) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-6-19(4)13-10-16-15(14-19)8-9-17-18(2,3)11-7-12-20(16,17)5/h6,17H,1,7-14H2,2-5H3/t17-,19+,20+/m0/s1 |
| InChIKey |
OROJBMPJDLLRFD-DFQSSKMNSA-N |
| Molecular Weight |
272.476 g/mol |
| SMILES |
[C@]12([H])[C@@](C3=C(C[C@@](CC3)(C=C)C)CC1)(CCCC2(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840259 |
