| SpectraBase Spectrum ID |
AjXH80vm3aM |
| Name |
(1E,5E)-(S)-8-Isopropenyl-1,5-dimethyl-cyclodeca-1,5-diene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.187800773 u |
| Formula |
C15H24 |
| InChI |
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9,15H,1,5,7-8,10-11H2,2-4H3/b13-6+,14-9+/t15-/m0/s1 |
| InChIKey |
XMRKUJJDDKYUHV-SDFJSLCBSA-N |
| Molecular Weight |
204.357 g/mol |
| SMILES |
C([C@@]1(C\C=C\(CC\C=C\(CC1)C)C)[H])(=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958906 |
