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2-[(4-tert-butylphenoxy)methyl]-1-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole

View entire compound with spectra: 2 NMR

2-[(4-tert-butylphenoxy)methyl]-1-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole
SpectraBase Compound ID KKj3u60ODPv
InChI InChI=1S/C27H30N2O2/c1-20-8-7-9-23(18-20)30-17-16-29-25-11-6-5-10-24(25)28-26(29)19-31-22-14-12-21(13-15-22)27(2,3)4/h5-15,18H,16-17,19H2,1-4H3
InChIKey SGVPHHYOFFZINM-UHFFFAOYSA-N
Mol Weight 414.55 g/mol
Molecular Formula C27H30N2O2
Exact Mass 414.230728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90QIPMTOsRq
Name 2-[(4-Tert-butylphenoxy)methyl]-1-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.230728212 u
Formula C27H30N2O2
InChI InChI=1S/C27H30N2O2/c1-20-8-7-9-23(18-20)30-17-16-29-25-11-6-5-10-24(25)28-26(29)19-31-22-14-12-21(13-15-22)27(2,3)4/h5-15,18H,16-17,19H2,1-4H3
InChIKey SGVPHHYOFFZINM-UHFFFAOYSA-N
Molecular Weight 414.549 g/mol
SMILES C1(=NC2=CC=CC=C2N1CCOC=1C=C(C)C=CC1)COC1=CC=C(C(C)(C)C)C=C1