Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00018280
Compound Identification
Common Name18-Oxocortisol,1TMS,isomer#1
Structure
Average Molecular Weight448.2281
SMILESC[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C=O)[C@H]1CC[C@@]2(O[Si](C)(C)C)C(=O)CO
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3450.4092
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices