| SpectraBase Spectrum ID |
1q15k2ZuPVk |
| Name |
3-[(E)-3-Methyl-6-(4-prop-1-en-2-ylcyclohexen-1-yl)hex-3-enyl]cyclohex-2-en-1-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.245315649 u |
| Formula |
C22H32O |
| InChI |
InChI=1S/C22H32O/c1-17(2)21-14-12-19(13-15-21)7-4-6-18(3)10-11-20-8-5-9-22(23)16-20/h6,12,16,21H,1,4-5,7-11,13-15H2,2-3H3/b18-6+ |
| InChIKey |
NOTUUAYPXLHQFE-NGYBGAFCSA-N |
| SMILES |
C1(C=C(CCC1)CC\C(=C\CCC1=CCC(CC1)C(=C)C)C)=O |
![3-[(E)-3-methyl-6-(4-prop-1-en-2-ylcyclohexen-1-yl)hex-3-enyl]cyclohex-2-en-1-one](/api/spectrum/1q15k2ZuPVk/structure.png?h=300&w=458 "3-[(E)-3-methyl-6-(4-prop-1-en-2-ylcyclohexen-1-yl)hex-3-enyl]cyclohex-2-en-1-one")
