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4-chloro-N-{1-[2-(dimethylamino)ethyl]-1H-benzimidazol-2-yl}benzamide
SpectraBase Compound ID CCcM75ZXVHV
InChI InChI=1S/C18H19ClN4O/c1-22(2)11-12-23-16-6-4-3-5-15(16)20-18(23)21-17(24)13-7-9-14(19)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,21,24)
InChIKey RTXRYXVOIBDWFR-UHFFFAOYSA-N
Mol Weight 342.83 g/mol
Molecular Formula C18H19ClN4O
Exact Mass 342.124739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Dsj27QpgJ6
Name 4-Chloro-N-{1-[2-(dimethylamino)ethyl]-1H-benzimidazol-2-yl}benzamide
Comments Computed using HOSE algorithm
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Exact Mass 342.124738947 u
Formula C18H19ClN4O
InChI InChI=1S/C18H19ClN4O/c1-22(2)11-12-23-16-6-4-3-5-15(16)20-18(23)21-17(24)13-7-9-14(19)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,21,24)
InChIKey RTXRYXVOIBDWFR-UHFFFAOYSA-N
Molecular Weight 342.830 g/mol
SMILES N(C=1N(C=2C=CC=CC2N1)CCN(C)C)C(C1=CC=C(C=C1)Cl)=O