Showing RIpred-Card for 4-Hydroxyglucobrassicin,6TMS,isomer#5 (RI01701705)

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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 IDRI01701705
Compound Identification
Common Name4-Hydroxyglucobrassicin,6TMS,isomer#5
Structure
Average Molecular Weight896.2931
SMILESC[Si](C)(C)OCC1OC(S/C(CC2=CN([Si](C)(C)C)C3=CC=CC(O[Si](C)(C)C)=C23)=N\OS(=O)(=O)O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4081.3862
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices