| SpectraBase Spectrum ID |
4YlH6QYNbeF |
| Name |
Acetic acid (S)-4-(4-iodo-3-oxo-butyl)-7a-methyl-5-((S)-3-methyl-5-oxo-[1,2]dioxolan-3-yl)-octahydro-inden-1-yl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H29IO6 |
| InChI |
InChI=1S/C20H29IO6/c1-12(22)25-17-7-6-15-14(5-4-13(23)11-21)16(8-9-19(15,17)2)20(3)10-18(24)26-27-20/h14-17H,4-11H2,1-3H3/t14?,15?,16?,17?,19-,20-/m0/s1 |
| InChIKey |
CQTDDFVFXXXHHV-ZFJXHIGWSA-N |
| Molecular Weight |
492.350 g/mol |
| SMILES |
[C@]12(C(C(CCC(=O)CI)C([C@@]3(CC(=O)OO3)C)CC1)CCC2OC(=O)C)C |
| SPLASH |
splash10-0udi-0092000000-5601f6d9174465f48156 |
| Source of Spectrum |
J-60-8216-15 |
| Wiley ID |
1397483 |
![Acetic acid (S)-4-(4-iodo-3-oxo-butyl)-7a-methyl-5-((S)-3-methyl-5-oxo-[1,2]dioxolan-3-yl)-octahydro-inden-1-yl ester](/api/spectrum/4YlH6QYNbeF/structure.png?h=300&w=458 "Acetic acid (S)-4-(4-iodo-3-oxo-butyl)-7a-methyl-5-((S)-3-methyl-5-oxo-[1,2]dioxolan-3-yl)-octahydro-inden-1-yl ester")
