Showing RIpred-Card for PS(14:1(9Z)/LTE4) (RI01663049)

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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 IDRI01663049
Compound Identification
Common NamePS(14:1(9Z)/LTE4)
Structure
Average Molecular Weight888.4571
SMILESCCCCC\C=C/C\C=C/C=C/C=C/[C@@H](SC[C@H](N)C(=O)O[C@H](COC(=O)CCCCCCC\C=C/CCCC)COP(O)(=O)OC[C@H](N)C(O)=O)[C@@H](O)CCCC(O)=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index7256.4727
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices