Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00017632
Compound Identification
Common Name16b-Hydroxyestrone,3TBDMS,isomer#1
Structure
Average Molecular Weight628.4163
SMILESCC(C)(C)[Si](C)(C)OC1=C(O[Si](C)(C)C(C)(C)C)[C@@]2(C)CC[C@@H]3C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4CC[C@H]3[C@@H]2C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3214.0232
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices