Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:45:20 UTC |
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Update Date | 2025-03-21 18:00:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00027457 |
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Frequency | 138.2 |
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Structure | |
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Chemical Formula | C13H17Cl2N |
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Molecular Mass | 257.0738 |
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SMILES | CNC1CCC(c2ccc(Cl)c(Cl)c2)CC1 |
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InChI Key | NULZETMHSKIHTQ-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | halobenzenes |
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Direct Parent | dichlorobenzenes |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | aryl chloridesdialkylamineshydrocarbon derivativesorganochloridesorganopnictogen compounds |
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Substituents | aryl chloridesecondary aliphatic amineorganochloridesecondary amineorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,2-dichlorobenzeneorganic nitrogen compoundamine |
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