Molecule ID: mol3594
SMILES: CC1CCCC(C)(C)N1C
InChI: InChI=1S/C9H19N/c1-8-6-5-7-9(2,3)10(8)4/h8H,5-7H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.70 | IUPAC digitized pKa | 1 » 0 |
| 10.70 | OCHEM | 1 » 0 |
| 10.76 | Datawarrior | 1 » 0 |
| 10.76 | OCHEM | 1 » 0 |
| 10.76 | AttenGpKa training set | 1 » 0 |