Showing RIpred-Card for PI(16:2(9Z,12Z)/5-iso PGF2VI) (RI01661559)

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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 IDRI01661559
Compound Identification
Common NamePI(16:2(9Z,12Z)/5-iso PGF2VI)
Structure
Average Molecular Weight876.4636
SMILESCCCCC[C@@H](O)\C=C/[C@H]1[C@H](O)C[C@H](O)[C@H]2C\C=C/CC(=O)O[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCC)COP(O)(=O)O[C@@H]([C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H]1O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5735.1597
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices