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1,1':4',1'':3'',1''':4''',1'''':4'''',1'''''-sexiphenyl

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

1,1':4',1'':3'',1''':4''',1'''':4'''',1'''''-sexiphenyl
SpectraBase Compound ID 3NZKTSLkST1
InChI InChI=1S/C36H26/c1-3-8-27(9-4-1)29-14-16-31(17-15-29)32-20-24-34(25-21-32)36-13-7-12-35(26-36)33-22-18-30(19-23-33)28-10-5-2-6-11-28/h1-26H
InChIKey NUGUZNZHKUIEGW-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 Jg7uEp1Mhrt
Name 1,1':4',1'':3'',1''':4''',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/c1-3-8-27(9-4-1)29-14-16-31(17-15-29)32-20-24-34(25-21-32)36-13-7-12-35(26-36)33-22-18-30(19-23-33)28-10-5-2-6-11-28/h1-26H
InChIKey NUGUZNZHKUIEGW-UHFFFAOYSA-N
Molecular Weight 458.604 g/mol
SMILES C=1C=C(C=CC1)C=1C=CC(C=2C=CC(C=3C=C(C4=CC=C(C5=CC=CC=C5)C=C4)C=CC3)=CC2)=CC1