Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01662951
Compound Identification
Common NamePS(14:1(9Z)/20:3(5Z,11Z,14Z)-O(8,9))
Structure
Average Molecular Weight769.453
SMILES[H][C@@](COC(=O)CCCCCCC\C=C/CCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4727.0767
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices