| SpectraBase Spectrum ID |
LwM0JteOUSx |
| Name |
[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-2-methyl-5-(1-methylethenyl)cyclohexalidene]acetic acid ethyl ester |
| CAS Registry Number |
123836-52-2 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25Cl3O7 |
| InChI |
InChI=1S/C19H25Cl3O7/c1-6-26-16(24)9-14-7-13(11(2)3)8-15(28-12(4)23)18(14,5)29-17(25)27-10-19(20,21)22/h9,13,15H,2,6-8,10H2,1,3-5H3/b14-9+/t13-,15-,18+/m1/s1 |
| InChIKey |
XZLLYWMJRMTVLQ-RYSBDFHMSA-N |
| Molecular Weight |
471.761 g/mol |
| SMILES |
[C@@]1(\C(C[C@](C[C@]1(OC(=O)C)[H])(C(=C)C)[H])=C\C(=O)OCC)(OC(=O)OCC(Cl)(Cl)Cl)C |
| SPLASH |
splash10-0006-9004100000-be81b60478778ad346e2 |
| Source of Spectrum |
J-55-245-3 |
| Synonyms |
Ethyl (2E)-((2S,3R,5R)-3-(acetyloxy)-5-isopropenyl-2-methyl-2-{[(2,2,2-trichloroethoxy)carbonyl]oxy}cyclohexylidene)ethanoate |
| Wiley ID |
1392721 |
![[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-2-methyl-5-(1-methylethenyl)cyclohexalidene]acetic acid ethyl ester](/api/spectrum/LwM0JteOUSx/structure.png?h=300&w=458 "[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-2-methyl-5-(1-methylethenyl)cyclohexalidene]acetic acid ethyl ester")
