| 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