| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:22 UTC |
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| Update Date | 2025-03-25 01:01:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250253 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H5ClF2O |
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| Molecular Mass | 189.9997 |
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| SMILES | O=C(c1ccccc1)C(F)(F)Cl |
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| InChI Key | MNOONJNILVDLSW-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 | alkyl chloridesalkyl fluoridesalpha-chloroketonesaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganochloridesorganofluoridesorganooxygen compounds |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonealkyl fluorideorganofluoridealkyl chlorideorganochloridebenzoylorganohalogen compoundalpha-chloroketonearomatic homomonocyclic compoundorganic oxidealpha-haloketonealkyl halidehydrocarbon derivativebenzenoidalkyl-phenylketone |
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