Showing RIpred-Card for Quadrangularin A,4TMS,isomer#98 (RI01716469)

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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 IDRI01716469
Compound Identification
Common NameQuadrangularin A,4TMS,isomer#98
Structure
Average Molecular Weight866.3005
SMILESC[Si](C)(C)OC1=CC=C([C@H]2OC3=CC(O)=CC(O)=C3[C@H](C3=C(O[Si](C)(C)C)C=C4O[C@H](C5=CC=C(O)C(O)=C5)[C@@H](O)CC4=C3O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5099.12
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices