Molecule ID: mol12892

SMILES: C=CCC(C)(O)CN(CC)CC

InChI: InChI=1S/C10H21NO/c1-5-8-10(4,12)9-11(6-2)7-3/h5,12H,1,6-9H2,2-4H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.71 Datawarrior 1 » 0
9.71 OCHEM 1 » 0
9.71 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization