| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:24:21 UTC |
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| Update Date | 2025-03-21 18:38:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00120782 |
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| Frequency | 21.5 |
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| Structure | |
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| Chemical Formula | C9H10F3NO |
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| Molecular Mass | 205.0714 |
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| SMILES | NCCc1ccc(OC(F)(F)F)cc1 |
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| InChI Key | HHLGARPFXWIYTE-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 | phenol ethers |
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| Subclass | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl fluorideshydrocarbon derivativesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenoxy compoundstrihalomethanes |
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| Substituents | halomethanephenol ethermonocyclic benzene moietytrihalomethanealkyl fluorideorganofluorideorganohalogen compoundaromatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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