Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00000207
Compound Identification
Common NameCortexolone,3TMS,isomer#2
Structure
Average Molecular Weight562.333
SMILESC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO[Si](C)(C)C)O[Si](C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3296.4827
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices