Showing RIpred-Card for trans-3-Hydroxycotinine glucuronide,3TBDMS,isomer#2 (RI00066407)

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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 IDRI00066407
Compound Identification
Common Nametrans-3-Hydroxycotinine glucuronide,3TBDMS,isomer#2
Structure
Average Molecular Weight710.3814
SMILESCN1C(=O)[C@H](O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)CC1C1=CC=CN=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index3597.0576
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices