Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00018311
Compound Identification
Common Name18-Oxocortisol,2TBDMS,isomer#2
Structure
Average Molecular Weight604.3615
SMILESCC(C)(C)[Si](C)(C)O[C@H]1C[C@@]2(C=O)[C@@H](CC[C@@]2(O[Si](C)(C)C(C)(C)C)C(=O)CO)[C@@H]2CCC3=CC(=O)CC[C@]3(C)[C@@H]12
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3824.5083
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices