Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01708878
Compound Identification
Common Name4-hydroxy-2-nonenal-[L-Cys] conjugate,1TBDMS,isomer#2
Structure
Average Molecular Weight388.1978
SMILESCCCCCC(O)C(C=CO[Si](C)(C)C(C)(C)C)SCC([N+])C(=O)[O-]
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3023.9739
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices