Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01712570
Compound Identification
Common Nameferroleghemoglobin,1TBDMS,isomer#3
Structure
Average Molecular Weight726.303
SMILESC=CC1=C(C)C2=CC3=C(C=C)C(C)=C4C=C5C(C)=C(CCC(C)=O)C6=[N+]5[Fe+2]5(N43)N3C(=CC1=[N+]25)C(C)=C(CCC(=C)O[Si](C)(C)C(C)(C)C)C3=C6
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5933.5894
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices