Showing RIpred-Card for 2,4-dinitrophenyl-S-glutathione,2TBDMS,isomer#1 (RI01704100)

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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 IDRI01704100
Compound Identification
Common Name2,4-dinitrophenyl-S-glutathione,2TBDMS,isomer#1
Structure
Average Molecular Weight697.2275
SMILESCC(C)(C)[Si](C)(C)N(CC(=O)[O-])C(=O)C(CSC1=CC=C([N+](=O)[O-])C=C1[N+](=O)[O-])N(C(=O)CCC([N+])C(=O)[O-])[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5124.9097
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices