Molecule ID: mol31787

SMILES: O=C(O)/C=C/C(=O)c1cccnc1

InChI: InChI=1S/C9H7NO3/c11-8(3-4-9(12)13)7-2-1-5-10-6-7/h1-6H,(H,12,13)/b4-3+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.82 OCHEM 0 » -1
3.82 OCHEM 0 » -1
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Charge States and Microspecies Visualization