| 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 | RI00062266 |
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|
| Compound Identification |
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| Common Name | Heme O |
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| Structure | |
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| Average Molecular Weight | 838.3757 |
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| SMILES | CC(C)=CCC\C(C)=C\CC\C(C)=C\CCC(O)C1=C(C)/C2=C/C3=N/C(=C\C4=C(CCC(O)=O)C(C)=C5/C=C6\N=C(\C=C\1/N\2[Fe]N45)C(C)=C6C=C)/C(CCC(O)=O)=C3C |
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| Physical Properties |
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| Predicted Properties | | Property | Value | Reference |
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| Retention Index | 6267.629 |
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| References |
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| General References | Accurate Prediction of Gas Chromatographic Kováts Retention Indices |
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