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2,4-Di(4-methoxybenzoyl)-3,5,6-triphenylaniline

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

2,4-Di(4-methoxybenzoyl)-3,5,6-triphenylaniline
SpectraBase Compound ID 3jYF7HVx97V
InChI InChI=1S/C40H31NO4/c1-44-31-22-18-29(19-23-31)39(42)36-33(26-12-6-3-7-13-26)35(28-16-10-5-11-17-28)38(41)37(34(36)27-14-8-4-9-15-27)40(43)30-20-24-32(45-2)25-21-30/h3-25H,41H2,1-2H3
InChIKey SQPZAPXUMUAEEU-UHFFFAOYSA-N
Mol Weight 589.7 g/mol
Molecular Formula C40H31NO4
Exact Mass 589.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ItIllTd70r
Name 2,4-di(4-Methoxybenzoyl)-3,5,6-triphenylaniline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 589.225308478 u
Formula C40H31NO4
InChI InChI=1S/C40H31NO4/c1-44-31-22-18-29(19-23-31)39(42)36-33(26-12-6-3-7-13-26)35(28-16-10-5-11-17-28)38(41)37(34(36)27-14-8-4-9-15-27)40(43)30-20-24-32(45-2)25-21-30/h3-25H,41H2,1-2H3
InChIKey SQPZAPXUMUAEEU-UHFFFAOYSA-N
Molecular Weight 589.691 g/mol
SMILES C1(=C(C(C(C=2C=CC(=CC2)OC)=O)=C(C(=C1N)C=1C=CC=CC1)C=1C=CC=CC1)C=1C=CC=CC1)C(C=1C=CC(=CC1)OC)=O