| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:36 UTC |
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| Update Date | 2025-03-21 18:03:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00044811 |
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| Frequency | 75.4 |
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| Structure | |
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| Chemical Formula | C8H9Br |
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| Molecular Mass | 183.9888 |
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| SMILES | Cc1ccc(Br)cc1C |
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| InChI Key | QOGHRLGTXVMRLM-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 | xylenes |
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| Direct Parent | o-xylenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl bromidesbromobenzeneshydrocarbon derivativesorganobromides |
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| Substituents | bromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compoundo-xyleneorganobromidehydrocarbon derivativehalobenzenearyl bromide |
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