Showing RIpred-Card for 3-dehydrocholate,3TBDMS,isomer#2 (RI01708280)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01708280
Compound Identification
Common Name3-dehydrocholate,3TBDMS,isomer#2
Structure
Average Molecular Weight747.5241
SMILESCC(CCC(=O)[O-])C1CCC2C3C(O[Si](C)(C)C(C)(C)C)CC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C(C)(C)C)C12C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3866.8816
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices