| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:57:56 UTC |
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| Update Date | 2025-03-24 22:26:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01197591 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C3F3NO |
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| Molecular Mass | 122.9932 |
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| SMILES | N#CC(=O)C(F)(F)F |
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| InChI Key | WMMSMHCWCRMQLB-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 | alpha-haloketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyl cyanidesalkyl fluorideshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundnitrilealkyl fluorideorganofluorideorganohalogen compoundorganic oxideacyl cyanideorganonitrogen compoundorganopnictogen compoundalpha-haloketonealkyl halidehydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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