Molecule ID: mol15244
SMILES: CCCCCC/N=C/c1c(C)cnc(C)c1O
InChI: InChI=1S/C14H22N2O/c1-4-5-6-7-8-15-10-13-11(2)9-16-12(3)14(13)17/h9-10,17H,4-8H2,1-3H3/b15-10+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.39 | Datawarrior | 2 » 1 |
| 6.22 | Datawarrior | 1 » 0 |