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3-Tert-butyl-N-(4-methoxybenzyl)-1-phenyl-1H-pyrazol-5-amine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Tert-butyl-N-(4-methoxybenzyl)-1-phenyl-1H-pyrazol-5-amine
SpectraBase Compound ID JqrEm5KC2Ms
InChI InChI=1S/C21H25N3O/c1-21(2,3)19-14-20(24(23-19)17-8-6-5-7-9-17)22-15-16-10-12-18(25-4)13-11-16/h5-14,22H,15H2,1-4H3
InChIKey OERFTGCMLAAQBH-UHFFFAOYSA-N
Mol Weight 335.45 g/mol
Molecular Formula C21H25N3O
Exact Mass 335.199762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1cAt34L6SEW
Name 3-Tert-butyl-N-(4-methoxybenzyl)-1-phenyl-1H-pyrazol-5-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.199762436 u
Formula C21H25N3O
InChI InChI=1S/C21H25N3O/c1-21(2,3)19-14-20(24(23-19)17-8-6-5-7-9-17)22-15-16-10-12-18(25-4)13-11-16/h5-14,22H,15H2,1-4H3
InChIKey OERFTGCMLAAQBH-UHFFFAOYSA-N
Molecular Weight 335.451 g/mol
SMILES C=1(N(N=C(C1)C(C)(C)C)C=1C=CC=CC1)NCC1=CC=C(C=C1)OC