Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI00017472
Compound Identification
Common Name3b-Hydroxy-5-cholenoic acid,2TMS,isomer#1
Structure
Average Molecular Weight518.3611
SMILESC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@@]21C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3248.1887
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices