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3-(p-Chlorophenyl)-4'-isopropoxy-4-phenyl-2-pyrazoline-1-carboxanilide
SpectraBase Compound ID ABTaPYgp4cP
InChI InChI=1S/C25H24ClN3O2/c1-17(2)31-22-14-12-21(13-15-22)27-25(30)29-16-23(18-6-4-3-5-7-18)24(28-29)19-8-10-20(26)11-9-19/h3-15,17,23H,16H2,1-2H3,(H,27,30)
InChIKey IBIZADGQRDCACZ-UHFFFAOYSA-N
Mol Weight 433.94 g/mol
Molecular Formula C25H24ClN3O2
Exact Mass 433.155705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IPzWWb7y3u
Name 3-(p-Chlorophenyl)-4'-isopropoxy-4-phenyl-2-pyrazoline-1-carboxanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.155704723 u
Formula C25H24ClN3O2
InChI InChI=1S/C25H24ClN3O2/c1-17(2)31-22-14-12-21(13-15-22)27-25(30)29-16-23(18-6-4-3-5-7-18)24(28-29)19-8-10-20(26)11-9-19/h3-15,17,23H,16H2,1-2H3,(H,27,30)
InChIKey IBIZADGQRDCACZ-UHFFFAOYSA-N
Molecular Weight 433.939 g/mol
SMILES N(C(N1N=C(C(C1)C1=CC=CC=C1)C=1C=CC(=CC1)Cl)=O)C=1C=CC(=CC1)OC(C)C