Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01708857
Compound Identification
Common Name4-hydroxy-2-nonenal-[Cys-Gly] conjugate,1TBDMS,isomer#3
Structure
Average Molecular Weight445.2192
SMILESCCCCCC(O)C(CC=O)SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3569.676
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices