Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00017623
Compound Identification
Common Name16b-Hydroxyestrone,2TBDMS,isomer#3
Structure
Average Molecular Weight514.3298
SMILESCC(C)(C)[Si](C)(C)OC1=C(O)C[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC=C4[C@H]3CC[C@]12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3331.4954
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices