HIT ID: HIT212686736
Cas No: 1216757-55-9
分子式: C13H17NO3S
分子量: 270.32
常用名: Rasagiline 13C3 mesylate racemic
常用名: Rasagiline 13C3 mesylate racemic
氢键受体数 (HBA): 1
氢键供体数 (HBD): 1
LogP: 2.303902
IUPAC: N-[(1,2,3-13C3)prop-2-yn-1-yl]-2,3-dihydro-1H-inden-1-amine; methanesulfonic acid
IUPAC: N-[(1,2,3-13C3)prop-2-yn-1-yl]-2,3-dihydro-1H-inden-1-amine; methanesulfonic acid
SMILES: CS(O)(=O)=O.[13CH]#[13C][13CH2]NC1CCc2ccccc12
SMILES: CS(O)(=O)=O.[13CH]#[13C][13CH2]NC1CCc2ccccc12
InChI key: JDBJJCWRXSVHOQ-IZHPGBHVSA-N