Showing RIpred-Card for 3-Hydroxyphenylacetylglutamine sulfate,3TBDMS,isomer#3 (RI01722971)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722971
Compound Identification
Common Name3-Hydroxyphenylacetylglutamine sulfate,3TBDMS,isomer#3
Structure
Average Molecular Weight674.2909
SMILESCC(C)(C)[Si](C)(C)N=C(O[Si](C)(C)C(C)(C)C)[C@H](N=C(CC1=CC=CC(OS(=O)(=O)O)=C1)O[Si](C)(C)C(C)(C)C)C(=O)O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3425.018
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices