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2,6-ditert-butyl-4-(1,3-diphenyl-1H-pyrazol-5-yl)phenol
SpectraBase Compound ID AGiVORBJRe7
InChI InChI=1S/C29H32N2O/c1-28(2,3)23-17-21(18-24(27(23)32)29(4,5)6)26-19-25(20-13-9-7-10-14-20)30-31(26)22-15-11-8-12-16-22/h7-19,32H,1-6H3
InChIKey HUBYERZKIYEDRD-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C29H32N2O
Exact Mass 424.251464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQo6PIaZkKX
Name 2,6-Ditert-butyl-4-(1,3-diphenyl-1H-pyrazol-5-yl)phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.251463657 u
Formula C29H32N2O
InChI InChI=1S/C29H32N2O/c1-28(2,3)23-17-21(18-24(27(23)32)29(4,5)6)26-19-25(20-13-9-7-10-14-20)30-31(26)22-15-11-8-12-16-22/h7-19,32H,1-6H3
InChIKey HUBYERZKIYEDRD-UHFFFAOYSA-N
Molecular Weight 424.588 g/mol
SMILES OC=1C(=CC(C=2N(N=C(C3=CC=CC=C3)C2)C2=CC=CC=C2)=CC1C(C)(C)C)C(C)(C)C