Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00001256
Compound Identification
Common NameAldosterone,3TBDMS,isomer#2
Structure
Average Molecular Weight702.4531
SMILESCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@]12C=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3921.767
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices