Showing RIpred-Card for PA(20:3(8Z,11Z,14Z)-2OH(5,6)/a-21:0) (RI01635628)

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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 IDRI01635628
Compound Identification
Common NamePA(20:3(8Z,11Z,14Z)-2OH(5,6)/a-21:0)
Structure
Average Molecular Weight800.5567
SMILES[H][C@@](COC(=O)CCCC(O)C(O)C\C=C/C\C=C/C\C=C/CCCCC)(COP(O)(O)=O)OC(=O)CCCCCCCCCCCCCCCCC(C)CC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5638.5146
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices