Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00020126
Compound Identification
Common Name16-Ketoestradiol,1TBDMS,isomer#3
Structure
Average Molecular Weight400.2434
SMILESCC(C)(C)[Si](C)(C)OC1=C(O)[C@@]2(C)CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]2C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3044.1074
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices