| SpectraBase Spectrum ID |
KF2DfxUPBjA |
| Name |
1-[(1R,2R,3S,4R)-3-[5-(Hydroxy)-5-methylhexyl]-2,4-dimethylcyclohexyl]ethanone |
| Alternate Name(s) |
1-[(1R,2R,3S,4R)-3-[5-(2-ethoxy-ethoxy)-5-methylhexyl]-2,4-dimethylcyclohexyl]ethanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H40O3 |
| InChI |
InChI=1S/C21H40O3/c1-7-23-14-15-24-21(5,6)13-9-8-10-19-16(2)11-12-20(17(19)3)18(4)22/h16-17,19-20H,7-15H2,1-6H3/t16-,17-,19+,20-/m1/s1 |
| InChIKey |
XGEIBJDFRBZAEC-IZBJGVDFSA-N |
| Molecular Weight |
340.548 g/mol |
| SMILES |
[C@]1([C@@](CC[C@]([C@@]1(CCCCC(OCCOCC)(C)C)[H])(C)[H])(C(=O)C)[H])(C)[H] |
| SPLASH |
splash10-0006-9200000000-0b94e7e0b9b4f62eb5e9 |
| Source of Spectrum |
QE-7-530-21 |
| Wiley ID |
845300 |
![1-[(1R,2R,3S,4R)-3-[5-(Hydroxy)-5-methylhexyl]-2,4-dimethylcyclohexyl]ethanone](/api/spectrum/KF2DfxUPBjA/structure.png?h=300&w=458 "1-[(1R,2R,3S,4R)-3-[5-(Hydroxy)-5-methylhexyl]-2,4-dimethylcyclohexyl]ethanone")
