pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.14	IUPAC digitized pKa	1	0	CC(=NO)C(C)(C)CCC[NH3+]	CC(=N[O-])C(C)(C)CCC[NH3+],CC(=NO)C(C)(C)CCCN	mol3240	CC(=NO)C(C)(C)CCCN
9.14000034332275	QSARToolbox	1	0	CC(=NO)C(C)(C)CCC[NH3+]	CC(=N[O-])C(C)(C)CCC[NH3+],CC(=NO)C(C)(C)CCCN	mol3240	CC(=NO)C(C)(C)CCCN