Showing RIpred-Card for Bilirubin,2TMS,isomer#12 (RI00003006)

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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 IDRI00003006
Compound Identification
Common NameBilirubin,2TMS,isomer#12
Structure
Average Molecular Weight728.3425
SMILESC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4880.3745
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices