Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00020116
Compound Identification
Common Name16-Ketoestradiol,1TMS,isomer#2
Structure
Average Molecular Weight358.1964
SMILESC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CC(=O)[C@@H]2O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2823.505
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices