Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722957
Compound Identification
Common Name3-Hydroxyphenylacetylglutamine sulfate,1TBDMS,isomer#4
Structure
Average Molecular Weight446.1179
SMILESCC(C)(C)[Si](C)(C)OS(=O)(=O)OC1=CC=CC(CC(O)=N[C@@H](C(=N)O)C(=O)O)=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index2961.995
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices