Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01723903
Compound Identification
Common NameNordeoxycholic acid,3TMS,isomer#1
Structure
Average Molecular Weight594.3956
SMILESCC(CC(=O)O[Si](C)(C)C)C1CCC2C3CCC4CC(O[Si](C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C)C12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3200.9453
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices