Property | Value |
---|---|
Metabolite name | Acetoacetic acid |
AMDB ID | 137 |
PubChem CID | 96 |
HMDB ID | HMDB0000060 |
KEGG ID | C00164 |
ChEBI ID | 15344 |
Molecular formula | C4H6O3 |
Molecular weight | 102.0886 |
Monoisotopic mass | 102.031694058 |
IUPAC name | 3-oxobutanoic acid |
Functional group | Multiplicity | Shift | Number of protons |
---|---|---|---|
CH3 | singlet | 2.265 | 3 |
CH2 | singlet | 3.43 | 2 |
Acetoacetate, Acetoacetic acid, 3-oxobutanoic acid