pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
17.1	IUPAC digitized pKa	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
16.14	Datawarrior	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
16.139999	OCHEM	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
18.0	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
16.5	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
17.1000003814697	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
17.9699993133545	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
15.539999961853	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
16.0699996948242	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O
16.8099994659424	QSARToolbox	0	-1	CC(C)O	CC(C)[O-]	mol5684	CC(C)O