Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722725
Compound Identification
Common NameDihydroxyphenylacetic acid sulfate,3TMS,isomer#1
Structure
Average Molecular Weight464.1177
SMILESC[Si](C)(C)OC1=CC=C(CC(=O)OS(=O)(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2449.4326
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices