Showing RIpred-Card for PI(PGJ2/16:2(9Z,12Z)) (RI01661544)

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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 IDRI01661544
Compound Identification
Common NamePI(PGJ2/16:2(9Z,12Z))
Structure
Average Molecular Weight884.4687
SMILESCCCCC[C@H](O)\C=C\[C@@H]1[C@@H](O)[C@@H](O)[C@H]2OP(O)(=O)OC[C@@H](COC(=O)CCC\C=C/C[C@@H](C=CC1=O)[C@@H](O)[C@H](O)[C@H]2O)OC(=O)CCCCCCC\C=C/C\C=C/CCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5742.5503
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices