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4-ethyl-3,5-bis(3-methoxyphenyl)-1-(2-methylbenzyl)-1H-pyrazole

View entire compound with spectra: 2 NMR

4-ethyl-3,5-bis(3-methoxyphenyl)-1-(2-methylbenzyl)-1H-pyrazole
SpectraBase Compound ID ABojPe54qNb
InChI InChI=1S/C27H28N2O2/c1-5-25-26(20-12-8-14-23(16-20)30-3)28-29(18-22-11-7-6-10-19(22)2)27(25)21-13-9-15-24(17-21)31-4/h6-17H,5,18H2,1-4H3
InChIKey FNYVMBLZMOWHGN-UHFFFAOYSA-N
Mol Weight 412.53 g/mol
Molecular Formula C27H28N2O2
Exact Mass 412.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BG5YC1P9QLc
Name 4-Ethyl-3,5-bis(3-methoxyphenyl)-1-(2-methylbenzyl)-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.215078148 u
Formula C27H28N2O2
InChI InChI=1S/C27H28N2O2/c1-5-25-26(20-12-8-14-23(16-20)30-3)28-29(18-22-11-7-6-10-19(22)2)27(25)21-13-9-15-24(17-21)31-4/h6-17H,5,18H2,1-4H3
InChIKey FNYVMBLZMOWHGN-UHFFFAOYSA-N
Molecular Weight 412.533 g/mol
SMILES COC1=CC(=CC=C1)C=1N(N=C(C1CC)C1=CC=CC(=C1)OC)CC1=CC=CC=C1C