Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722715
Compound Identification
Common NameCaffeic acid sulfate,1TMS,isomer#1
Structure
Average Molecular Weight330.024
SMILESC[Si](C)(C)OC(=O)/C=C/C1=CC=C([O-])C(OS(=O)(=O)[O-])=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2242.4932
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices