Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01708246
Compound Identification
Common Name2-succinyl-5-enolpyruvyl-6-hydroxy-3-cyclohexene-1-carboxylate,2TBDMS,isomer#1
Structure
Average Molecular Weight553.2306
SMILESC=C(OC1CC=C(C(=CCC(=O)[O-])O[Si](C)(C)C(C)(C)C)C(C(=O)[O-])C1O[Si](C)(C)C(C)(C)C)C(=O)[O-]
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3341.4507
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices