| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 00:12:26 UTC |
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| Update Date | 2025-03-21 18:32:37 UTC |
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| HMDB ID | HMDB0249032 |
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| Metabolite Identification |
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| DeepMet ID | DMID00091816 |
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| Name | Benzotrifluoride |
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| Frequency | 30.5 |
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| Structure | |
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| Chemical Formula | C7H5F3 |
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| Molecular Mass | 146.0343 |
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| SMILES | FC(F)(F)c1ccccc1 |
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| InChI Key | GETTZEONDQJALK-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 | trifluoromethylbenzenes |
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| Direct Parent | trifluoromethylbenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl fluorideshydrocarbon derivativeshydrofluorocarbonsorganofluorides |
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| Substituents | aromatic homomonocyclic compoundalkyl fluorideorganofluoridehydrofluorocarbonalkyl halidehydrocarbon derivativeorganohalogen compoundtrifluoromethylbenzene |
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