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1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl

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

1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl
SpectraBase Compound ID 4YQX122xPlk
InChI InChI=1S/C36H26/c1-3-11-27(12-4-1)29-19-23-31(24-20-29)33-15-7-9-17-35(33)36-18-10-8-16-34(36)32-25-21-30(22-26-32)28-13-5-2-6-14-28/h1-26H
InChIKey YPDFFIAAXRWYAK-UHFFFAOYSA-N
Mol Weight 458.6 g/mol
Molecular Formula C36H26
Exact Mass 458.203451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7WKeHTkapGQ
Name 1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.203450837 u
Formula C36H26
InChI InChI=1S/C36H26/c1-3-11-27(12-4-1)29-19-23-31(24-20-29)33-15-7-9-17-35(33)36-18-10-8-16-34(36)32-25-21-30(22-26-32)28-13-5-2-6-14-28/h1-26H
InChIKey YPDFFIAAXRWYAK-UHFFFAOYSA-N
Molecular Weight 458.604 g/mol
SMILES C1=CC=C(C2=CC=C(C3=C(C=4C(C5=CC=C(C=6C=CC=CC6)C=C5)=CC=CC4)C=CC=C3)C=C2)C=C1