Molecule ID: mol2583

SMILES: CCC(=O)O[C@]1(c2ccccc2)CC[N@](C)C[C@@H]1C

InChI: InChI=1S/C16H23NO2/c1-4-15(18)19-16(14-8-6-5-7-9-14)10-11-17(3)12-13(16)2/h5-9,13H,4,10-12H2,1-3H3/t13-,16+/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.70 Jensen 1 » 0
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Charge States and Microspecies Visualization