Showing RIpred-Card for PI(18:1(12Z)-2OH(9,10)/18:0) (RI01661706)

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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 IDRI01661706
Compound Identification
Common NamePI(18:1(12Z)-2OH(9,10)/18:0)
Structure
Average Molecular Weight896.5626
SMILES[H][C@@](COC(=O)CCCCCCC[C@@H](O)[C@H](O)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)CCCCCCCCCCCCCCCCC
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5582.3657
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices