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N-Cyclopentyl-2-[2-(pyridin-2-yl)-benzo[D]imidazol-1-yl]butanamide
SpectraBase Compound ID DuvSbtYelsf
InChI InChI=1S/C21H24N4O/c1-2-18(21(26)23-15-9-3-4-10-15)25-19-13-6-5-11-16(19)24-20(25)17-12-7-8-14-22-17/h5-8,11-15,18H,2-4,9-10H2,1H3,(H,23,26)
InChIKey YFRXUJNQXQCYCZ-UHFFFAOYSA-N
Mol Weight 348.45 g/mol
Molecular Formula C21H24N4O
Exact Mass 348.195011 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J8WHTAiVsEu
Name N-Cyclopentyl-2-[2-(pyridin-2-yl)-benzo[D]imidazol-1-yl]butanamide
Comments Computed using HOSE algorithm
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Exact Mass 348.195011408 u
Formula C21H24N4O
InChI InChI=1S/C21H24N4O/c1-2-18(21(26)23-15-9-3-4-10-15)25-19-13-6-5-11-16(19)24-20(25)17-12-7-8-14-22-17/h5-8,11-15,18H,2-4,9-10H2,1H3,(H,23,26)
InChIKey YFRXUJNQXQCYCZ-UHFFFAOYSA-N
Molecular Weight 348.450 g/mol
SMILES C(C(CC)N1C(=NC=2C1=CC=CC2)C1=CC=CC=N1)(=O)NC1CCCC1