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1-(2-Cyclohexylethyl)-2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzimidazole
SpectraBase Compound ID Da4iFxv3Za7
InChI InChI=1S/C26H34N2O/c1-19(2)22-14-13-20(3)17-25(22)29-18-26-27-23-11-7-8-12-24(23)28(26)16-15-21-9-5-4-6-10-21/h7-8,11-14,17,19,21H,4-6,9-10,15-16,18H2,1-3H3
InChIKey UPWVNXFUVZHGJZ-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C26H34N2O
Exact Mass 390.267114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3nt0VA7WRg3
Name 1-(2-Cyclohexylethyl)-2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzimidazole
Comments Computed using HOSE algorithm
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Exact Mass 390.267113722 u
Formula C26H34N2O
InChI InChI=1S/C26H34N2O/c1-19(2)22-14-13-20(3)17-25(22)29-18-26-27-23-11-7-8-12-24(23)28(26)16-15-21-9-5-4-6-10-21/h7-8,11-14,17,19,21H,4-6,9-10,15-16,18H2,1-3H3
InChIKey UPWVNXFUVZHGJZ-UHFFFAOYSA-N
Molecular Weight 390.571 g/mol
SMILES C1CCC(CCN2C(=NC3=C2C=CC=C3)COC2=C(C=CC(=C2)C)C(C)C)CC1