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Phenyl 2',3',6'-triphenyl-4-biphenylyl ether

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

Phenyl 2',3',6'-triphenyl-4-biphenylyl ether
SpectraBase Compound ID 2CXaQ0QvaaR
InChI InChI=1S/C36H26O/c1-5-13-27(14-6-1)33-25-26-34(28-15-7-2-8-16-28)36(35(33)29-17-9-3-10-18-29)30-21-23-32(24-22-30)37-31-19-11-4-12-20-31/h1-26H
InChIKey NICHFTFVEQKARN-UHFFFAOYSA-N
Mol Weight 474.6 g/mol
Molecular Formula C36H26O
Exact Mass 474.198365 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID BMJp9K6i6C5
Name Phenyl 2',3',6'-triphenyl-4-biphenylyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.198365456 u
Formula C36H26O
InChI InChI=1S/C36H26O/c1-5-13-27(14-6-1)33-25-26-34(28-15-7-2-8-16-28)36(35(33)29-17-9-3-10-18-29)30-21-23-32(24-22-30)37-31-19-11-4-12-20-31/h1-26H
InChIKey NICHFTFVEQKARN-UHFFFAOYSA-N
Molecular Weight 474.603 g/mol
SMILES C=1C=CC(=CC1)C=1C(C=2C=CC(=CC2)OC2=CC=CC=C2)=C(C(=CC1)C=1C=CC=CC1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Raman) 0.805919