| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:27 UTC |
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| Update Date | 2025-03-21 18:03:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041988 |
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| Frequency | 81.6 |
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| Structure | |
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| Chemical Formula | C8H10ClN |
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| Molecular Mass | 155.0502 |
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| SMILES | NCCc1cccc(Cl)c1 |
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| InChI Key | NRHVNPYOTNGECT-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 | chlorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chlorideshydrocarbon derivativesmonoalkylaminesorganochloridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridechlorobenzeneorganochlorideorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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