| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:46:53 UTC |
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| Update Date | 2025-03-21 18:01:07 UTC |
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| HMDB ID | HMDB0258843 |
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| Metabolite Identification |
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| DeepMet ID | DMID00031055 |
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| Name | Tert-butyl formate |
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| Frequency | 119.1 |
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| Structure | |
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| Chemical Formula | C5H10O2 |
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| Molecular Mass | 102.0681 |
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| SMILES | CC(C)(C)OC=O |
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| InChI Key | RUPAXCPQAAOIPB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acid derivatives |
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| Direct Parent | carboxylic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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