Showing RIpred-Card for Bilirubin,3TMS,isomer#6 (RI00003074)

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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 IDRI00003074
Compound Identification
Common NameBilirubin,3TMS,isomer#6
Structure
Average Molecular Weight800.3821
SMILESC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4956.8164
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices