| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:34:39 UTC |
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| Update Date | 2025-03-21 17:56:41 UTC |
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| HMDB ID | HMDB0034029 |
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| Metabolite Identification |
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| DeepMet ID | DMID00002993 |
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| Name | Isopropylbenzene |
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| Frequency | 1981.0 |
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| Structure | |
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| Chemical Formula | C9H12 |
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| Molecular Mass | 120.0939 |
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| SMILES | CC(C)c1ccccc1 |
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| InChI Key | RWGFKTVRMDUZSP-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 | cumenes |
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| Direct Parent | cumenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | phenylpropanessaturated hydrocarbons |
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| Substituents | phenylpropanearomatic homomonocyclic compoundsaturated hydrocarboncumenehydrocarbon |
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