| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:39 UTC |
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| Update Date | 2025-03-25 00:52:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193589 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12ClN |
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| Molecular Mass | 193.0658 |
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| SMILES | CN(C)CC#Cc1cccc(Cl)c1 |
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| InChI Key | UQDXQXOOEWXWOR-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 derivativesorganochloridesorganopnictogen compoundstrialkylamines |
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| Substituents | aryl chloridechlorobenzeneorganochloridetertiary aliphatic amineorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amine |
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