| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:48:17 UTC |
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| Update Date | 2025-03-21 18:01:42 UTC |
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| HMDB ID | HMDB0246089 |
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| Metabolite Identification |
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| DeepMet ID | DMID00034399 |
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| Name | 3'-Chloroacetophenone |
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| Frequency | 104.6 |
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| Structure | |
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| Chemical Formula | C8H7ClO |
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| Molecular Mass | 154.0185 |
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| SMILES | CC(=O)c1cccc(Cl)c1 |
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| InChI Key | UUWJBXKHMMQDED-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acetophenonesaryl alkyl ketonesaryl chloridesbenzoyl derivativeschlorobenzeneshydrocarbon derivativesorganic oxidesorganochloridesorganooxygen compounds |
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| Substituents | aryl chloridechlorobenzenemonocyclic benzene moietyaryl alkyl ketoneorganochloridebenzoylorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxideacetophenonehydrocarbon derivativebenzenoidhalobenzenealkyl-phenylketone |
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