pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.3	IUPAC digitized pKa	1	0	C[NH+](C)CCCO	CN(C)CCCO	mol203	CN(C)CCCO
9.76	Datawarrior	1	0	C[NH+](C)CCCO	CN(C)CCCO	mol203	CN(C)CCCO
9.7600002	OCHEM	1	0	C[NH+](C)CCCO	CN(C)CCCO	mol203	CN(C)CCCO
9.76000022888184	QSARToolbox	1	0	C[NH+](C)CCCO	CN(C)CCCO	mol203	CN(C)CCCO