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2-(4-(Tert-butyl)phenyl)-N-cyclohexyl-2-(2-methyl-1H-benzimidazol-1-yl)acetamide
SpectraBase Compound ID LJ93SaCi0WC
InChI InChI=1S/C26H33N3O/c1-18-27-22-12-8-9-13-23(22)29(18)24(25(30)28-21-10-6-5-7-11-21)19-14-16-20(17-15-19)26(2,3)4/h8-9,12-17,21,24H,5-7,10-11H2,1-4H3,(H,28,30)
InChIKey JANIWKLOONCJSC-UHFFFAOYSA-N
Mol Weight 403.6 g/mol
Molecular Formula C26H33N3O
Exact Mass 403.262363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nvne48BQjF
Name 2-(4-(Tert-butyl)phenyl)-N-cyclohexyl-2-(2-methyl-1H-benzimidazol-1-yl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 403.262362694 u
Formula C26H33N3O
InChI InChI=1S/C26H33N3O/c1-18-27-22-12-8-9-13-23(22)29(18)24(25(30)28-21-10-6-5-7-11-21)19-14-16-20(17-15-19)26(2,3)4/h8-9,12-17,21,24H,5-7,10-11H2,1-4H3,(H,28,30)
InChIKey JANIWKLOONCJSC-UHFFFAOYSA-N
Molecular Weight 403.570 g/mol
SMILES C1=CC=CC2=C1N(C(=N2)C)C(C1=CC=C(C=C1)C(C)(C)C)C(NC1CCCCC1)=O