| SpectraBase Spectrum ID |
G4Ip8nsiBL1 |
| Name |
1,3,3-Trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclohexene |
| 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/c1-6-12(2)9-10-14-13(3)8-7-11-15(14,4)5/h6,9-10H,7-8,11H2,1-5H3/b10-9+,12-6+ |
| InChIKey |
KUEVAPFABUUVHS-AYCKBHPDSA-N |
| Molecular Weight |
204.357 g/mol |
| SMILES |
C1(\C=C\C(=C\C)C)=C(CCCC1(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969436 |
![1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclohexene](/api/spectrum/G4Ip8nsiBL1/structure.png?h=300&w=458 "1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclohexene")
