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3-Methyl-N-(quinolin-8-yl)-[1,1':4',1''-terphenyl]-2-carboxamide

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3-Methyl-N-(quinolin-8-yl)-[1,1':4',1''-terphenyl]-2-carboxamide
SpectraBase Compound ID GcFl3GaIqK3
InChI InChI=1S/C29H22N2O/c1-20-8-5-13-25(23-17-15-22(16-18-23)21-9-3-2-4-10-21)27(20)29(32)31-26-14-6-11-24-12-7-19-30-28(24)26/h2-19H,1H3,(H,31,32)
InChIKey BGCRBIULPQSQJW-UHFFFAOYSA-N
Mol Weight 414.51 g/mol
Molecular Formula C29H22N2O
Exact Mass 414.173213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iher1s5cHJN
Name 3-Methyl-N-(quinolin-8-yl)-[1,1':4',1''-terphenyl]-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.173213335 u
Formula C29H22N2O
InChI InChI=1S/C29H22N2O/c1-20-8-5-13-25(23-17-15-22(16-18-23)21-9-3-2-4-10-21)27(20)29(32)31-26-14-6-11-24-12-7-19-30-28(24)26/h2-19H,1H3,(H,31,32)
InChIKey BGCRBIULPQSQJW-UHFFFAOYSA-N
Molecular Weight 414.508 g/mol
SMILES C=1(C(=C(C=CC1)C)C(=O)NC=1C=CC=C2C=CC=NC12)C=1C=CC(=CC1)C=1C=CC=CC1