Showing RIpred-Card for PS(PGJ2/18:1(11Z)) (RI01664715)

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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 IDRI01664715
Compound Identification
Common NamePS(PGJ2/18:1(11Z))
Structure
Average Molecular Weight839.4949
SMILESCCCCCC\C=C/CCCCCCCCCC(=O)O[C@H](COC(=O)CCC\C=C/C[C@H]1C=CC(=O)[C@@H]1\C=C\[C@@H](O)CCCCC)COP(O)(=O)OC[C@H](N)C(O)=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5262.404
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices