Molecule ID: mol31803

SMILES: CC(C)=CCC1(C(C)(C)C)C(=O)NC(=O)NC1=O

InChI: InChI=1S/C13H20N2O3/c1-8(2)6-7-13(12(3,4)5)9(16)14-11(18)15-10(13)17/h6H,7H2,1-5H3,(H2,14,15,16,17,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization