Molecule ID: mol13571
SMILES: CCO[C@H]1C[C@H]1C(=O)O
InChI: InChI=1S/C6H10O3/c1-2-9-5-3-4(5)6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/t4-,5+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.83 | Datawarrior | 0 » -1 |
| 4.83 | AttenGpKa training set | 0 » -1 |