| SpectraBase Spectrum ID |
hp0YNB1u3S |
| Name |
3-[2-(4-Isopropenyl-1,2-dimethyl-6-oxocyclohexyl)ethyl]cyclohex-2-enone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.208930140 u |
| Formula |
C19H28O2 |
| InChI |
InChI=1S/C19H28O2/c1-13(2)16-10-14(3)19(4,18(21)12-16)9-8-15-6-5-7-17(20)11-15/h11,14,16H,1,5-10,12H2,2-4H3 |
| InChIKey |
HBHVRSJVXVTREY-UHFFFAOYSA-N |
| SMILES |
C1(C=C(CCC1)CCC1(C(CC(CC1=O)C(=C)C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933233 |
![3-[2-(4-Isopropenyl-1,2-dimethyl-6-oxocyclohexyl)ethyl]cyclohex-2-enone](/api/spectrum/hp0YNB1u3S/structure.png?h=300&w=458 "3-[2-(4-Isopropenyl-1,2-dimethyl-6-oxocyclohexyl)ethyl]cyclohex-2-enone")
