Showing RIpred-Card for PS(18:2(9Z,12Z)/20:3(8Z,11Z,14Z)-O(5,6)) (RI01665234)

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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 IDRI01665234
Compound Identification
Common NamePS(18:2(9Z,12Z)/20:3(8Z,11Z,14Z)-O(5,6))
Structure
Average Molecular Weight823.4999
SMILES[H][C@@](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)(COP(O)(=O)OC[C@H](N)C(O)=O)OC(=O)CCCC1OC1C\C=C/C\C=C/C\C=C/CCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5050.6504
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices