Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01662410
Compound Identification
Common NamePI(20:3(8Z,11Z,14Z)/18:2(10E,12Z)+=O(9))
Structure
Average Molecular Weight898.5207
SMILES[H][C@@](COC(=O)CCCCCC\C=C/C\C=C/C\C=C/CCCCC)(COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)OC(=O)CCCCCCCC(=O)\C=C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5856.6133
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices