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1-(Cyclopropylmethyl)-2-(4-(o-tolyl)piperazin-1-yl)-1H-benzo[D]imidazole
SpectraBase Compound ID KSjnJP33c8Z
InChI InChI=1S/C22H26N4/c1-17-6-2-4-8-20(17)24-12-14-25(15-13-24)22-23-19-7-3-5-9-21(19)26(22)16-18-10-11-18/h2-9,18H,10-16H2,1H3
InChIKey IVQVSICGEXJWRU-UHFFFAOYSA-N
Mol Weight 346.48 g/mol
Molecular Formula C22H26N4
Exact Mass 346.215747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9giygh4GBhB
Name 1-(Cyclopropylmethyl)-2-(4-(o-tolyl)piperazin-1-yl)-1H-benzo[D]imidazole
Comments Computed using HOSE algorithm
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Exact Mass 346.215746853 u
Formula C22H26N4
InChI InChI=1S/C22H26N4/c1-17-6-2-4-8-20(17)24-12-14-25(15-13-24)22-23-19-7-3-5-9-21(19)26(22)16-18-10-11-18/h2-9,18H,10-16H2,1H3
InChIKey IVQVSICGEXJWRU-UHFFFAOYSA-N
Molecular Weight 346.478 g/mol
SMILES C=1(N(C2=C(N1)C=CC=C2)CC1CC1)N1CCN(CC1)C1=C(C=CC=C1)C