| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:14 UTC |
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| Update Date | 2025-03-21 18:41:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136883 |
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| Frequency | 18.3 |
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| Structure | |
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| Chemical Formula | C7H12Cl2 |
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| Molecular Mass | 166.0316 |
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| SMILES | CCCCCC=C(Cl)Cl |
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| InChI Key | SHIGTIVKNFPBPY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | vinyl halides |
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| Subclass | vinyl chlorides |
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| Direct Parent | vinyl chlorides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | chloroalkeneshydrocarbon derivativesorganochlorides |
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| Substituents | aliphatic acyclic compoundchloroalkeneorganochloridehaloalkenehydrocarbon derivativevinyl chloride |
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