Molecule ID: mol13440
SMILES: C#C[C@]1(O)C[C@@H](C)N[C@H]2CCCC[C@@H]21
InChI: InChI=1S/C12H19NO/c1-3-12(14)8-9(2)13-11-7-5-4-6-10(11)12/h1,9-11,13-14H,4-8H2,2H3/t9-,10+,11+,12+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.29 | Datawarrior | 1 » 0 |