pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.2	Datawarrior	0	-1	CCC(=O)NBr	CCC(=O)[N-]Br	mol15900	CCC(=O)NBr
8.1999998	OCHEM	0	-1	CCC(=O)NBr	CCC(=O)[N-]Br	mol15900	CCC(=O)NBr