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Concept information

Preferred term

2-methylacetoacetate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • -1

formula

  • C5H7O3

has_functional_parent

inchi

  • InChI=1S/C5H8O3/c1-3(4(2)6)5(7)8/h3H,1-2H3,(H,7,8)/p-1

inchikey

  • GCXJINGJZAOJHR-UHFFFAOYSA-M

is_conjugate_base_of

mass

  • 115.10728

monoisotopicmass

  • 115.04007

smiles

  • CC(C(C)=O)C([O-])=O

subset

  • 3_STAR

synonym EXACT

  • 2-methyl-3-oxobutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:19680

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