Showing RIpred-Card for Phosphoadenosine phosphosulfate,2TBDMS,isomer#12 (RI00060750)

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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 IDRI00060750
Compound Identification
Common NamePhosphoadenosine phosphosulfate,2TBDMS,isomer#12
Structure
Average Molecular Weight735.1592
SMILESCC(C)(C)[Si](C)(C)N(C1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](OP(=O)(O)O)[C@H]1O)[Si](C)(C)C(C)(C)C
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4214.1094
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices