| SpectraBase Spectrum ID |
LCabky5yDlW |
| Name |
2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.235144887 u |
| Formula |
C22H32O3 |
| InChI |
InChI=1S/C22H32O3/c1-15(9-10-20-16(2)8-7-11-22(20,5)6)12-19-13-17(3)21(14-24-19)25-18(4)23/h9-10,12-13,19,21H,7-8,11,14H2,1-6H3/b10-9+,15-12+/t19-,21-/m0/s1 |
| InChIKey |
OFNUTJYDNGCJHB-LIHYWDMFSA-N |
| Molecular Weight |
344.495 g/mol |
| SMILES |
C1(\C=C\C(=C\[C@]2(C=C(C)[C@](CO2)(OC(=O)C)[H])[H])C)=C(CCCC1(C)C)C |
![2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)-](/api/spectrum/LCabky5yDlW/structure.png?h=300&w=458 "2H-Pyran-3-ol, 3,6-dihydro-4-methyl-6-[2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl]-, acetate, [3.alpha.,6.alpha.(1E,3E)]-(.+-.)-")
