| SpectraBase Spectrum ID |
CCIycS5vMPD |
| Name |
[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-5-hydroxy-2-methylcyclohexylidene]-acetic acid ethyl ester |
| CAS Registry Number |
123836-55-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21Cl3O8 |
| InChI |
InChI=1S/C16H21Cl3O8/c1-4-24-13(22)6-10-5-11(21)7-12(26-9(2)20)15(10,3)27-14(23)25-8-16(17,18)19/h6,11-12,21H,4-5,7-8H2,1-3H3/b10-6+/t11-,12-,15+/m1/s1 |
| InChIKey |
WKJVNMMXVJTCMG-IHNYSWAOSA-N |
| Molecular Weight |
447.695 g/mol |
| SMILES |
O[C@]1(C[C@]([C@](\C(=C\C(=O)OCC)C1)(OC(=O)OCC(Cl)(Cl)Cl)C)(OC(=O)C)[H])[H] |
| SPLASH |
splash10-0006-9003000000-ed44e8527f0c9ec7ead1 |
| Source of Spectrum |
J-55-245-6 |
| Synonyms |
Ethyl (2E)-((2S,3R,5R)-3-(acetyloxy)-5-hydroxy-2-methyl-2-{[(2,2,2-trichloroethoxy)carbonyl]oxy}cyclohexylidene)ethanoate |
| Wiley ID |
1386455 |
![[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-5-hydroxy-2-methylcyclohexylidene]-acetic acid ethyl ester](/api/spectrum/CCIycS5vMPD/structure.png?h=300&w=458 "[2S-(1E,2.alpha.,3.alpha.,5.alpha.)]-[3-(acetyloxy)-2-[[(2,2,2-trichloroethoxy)carbonyl]oxy]-5-hydroxy-2-methylcyclohexylidene]-acetic acid ethyl ester")
