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Showing RIpred-Card for 2-Methoxyestrone,2TMS,isomer#1 (RI00000098)

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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 IDRI00000098
Compound Identification
Common Name2-Methoxyestrone,2TMS,isomer#1
Structure
Average Molecular Weight444.2516
SMILESCOC1=CC2=C(C=C1O[Si](C)(C)C)CC[C@@H]1[C@@H]2CC[C@]2(C)C(O[Si](C)(C)C)=CC[C@@H]12
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2734.413
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices