Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01665378
Compound Identification
Common NamePS(18:2(9Z,12Z)/18:2(9Z,11E)+=O(13))
Structure
Average Molecular Weight797.4843
SMILES[H][C@@](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCCCCC\C=C/C=C/C(=O)CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5047.958
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices