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6-[2-(4-phenyl-1-piperazinyl)ethyl]-2-(3-pyridinyl)-1H-benzimidazole
SpectraBase Compound ID FmPpqguqzIc
InChI InChI=1S/C24H25N5/c1-2-6-21(7-3-1)29-15-13-28(14-16-29)12-10-19-8-9-22-23(17-19)27-24(26-22)20-5-4-11-25-18-20/h1-9,11,17-18H,10,12-16H2,(H,26,27)
InChIKey ZXUWAYIMFNALKC-UHFFFAOYSA-N
Mol Weight 383.5 g/mol
Molecular Formula C24H25N5
Exact Mass 383.210996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJpfTvyHug1
Name 6-[2-(4-Phenyl-1-piperazinyl)ethyl]-2-(3-pyridinyl)-1H-benzimidazole
Comments Computed using HOSE algorithm
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Exact Mass 383.210995825 u
Formula C24H25N5
InChI InChI=1S/C24H25N5/c1-2-6-21(7-3-1)29-15-13-28(14-16-29)12-10-19-8-9-22-23(17-19)27-24(26-22)20-5-4-11-25-18-20/h1-9,11,17-18H,10,12-16H2,(H,26,27)
InChIKey ZXUWAYIMFNALKC-UHFFFAOYSA-N
Molecular Weight 383.499 g/mol
SMILES C1(=NC=2C=C(CCN3CCN(CC3)C3=CC=CC=C3)C=CC2N1)C=1C=NC=CC1