| Record Information |
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| Version | 1.0 |
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| Created at | 2023-04-11 00:00:00 UTC |
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| Updated at | 2023-04-11 00:00:00 UTC |
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| RI-Pred ID | RI01661317 |
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|
| Compound Identification |
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| Common Name | PI(20:4(6Z,8E,10E,14Z)-2OH(5S,12R)/16:1(9Z)) |
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| Structure | |
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| Average Molecular Weight | 888.5 |
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| SMILES | [H][C@@](COC(=O)CCC[C@H](O)\C=C/C=C/C=C/[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)CCCCCCC\C=C/CCCCCC |
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| Physical Properties |
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| Predicted Properties | | Property | Value | Reference |
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| Retention Index | 6522.077 |
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| References |
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| General References | Accurate Prediction of Gas Chromatographic Kováts Retention Indices |
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