Molecule ID: mol33173

SMILES: CC(C)c1cc(N)cc(C(C)(C)C)c1[N+](=O)[O-]

InChI: InChI=1S/C13H20N2O2/c1-8(2)10-6-9(14)7-11(13(3,4)5)12(10)15(16)17/h6-8H,14H2,1-5H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization