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3-[2-Quinolinylmethyl]-5-[3,4,5-trimethoxyphenyl]pyrazole

View entire compound with spectra: 1 NMR

3-[2-Quinolinylmethyl]-5-[3,4,5-trimethoxyphenyl]pyrazole
SpectraBase Compound ID DYOt9QNLGdp
InChI InChI=1S/C22H21N3O3/c1-26-20-10-15(11-21(27-2)22(20)28-3)19-13-17(24-25-19)12-16-9-8-14-6-4-5-7-18(14)23-16/h4-11,13H,12H2,1-3H3,(H,24,25)
InChIKey KHZFZOUVGZSUPT-UHFFFAOYSA-N
Mol Weight 375.43 g/mol
Molecular Formula C22H21N3O3
Exact Mass 375.158292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3hEMLnNbzw
Name 3-[2-Quinolinylmethyl]-5-[3,4,5-trimethoxyphenyl]pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.158291545 u
Formula C22H21N3O3
InChI InChI=1S/C22H21N3O3/c1-26-20-10-15(11-21(27-2)22(20)28-3)19-13-17(24-25-19)12-16-9-8-14-6-4-5-7-18(14)23-16/h4-11,13H,12H2,1-3H3,(H,24,25)
InChIKey KHZFZOUVGZSUPT-UHFFFAOYSA-N
Molecular Weight 375.428 g/mol
SMILES COC1=CC(=CC(OC)=C1OC)C1=CC(=NN1)CC1=NC2=C(C=CC=C2)C=C1