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5'-Phenyl-1,1':2',1'':4'',1'''-quaterphenyl
SpectraBase Compound ID FknQs73OpEj
InChI InChI=1S/C30H22/c1-4-10-23(11-5-1)25-16-18-27(19-17-25)29-21-20-28(24-12-6-2-7-13-24)22-30(29)26-14-8-3-9-15-26/h1-22H
InChIKey IEHZGHBERIJKOB-UHFFFAOYSA-N
Mol Weight 382.51 g/mol
Molecular Formula C30H22
Exact Mass 382.172151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9EDfPj2igQ
Name 5'-Phenyl-1,1':2',1'':4'',1'''-quaterphenyl
Comments Computed using HOSE algorithm
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Exact Mass 382.172150708 u
Formula C30H22
InChI InChI=1S/C30H22/c1-4-10-23(11-5-1)25-16-18-27(19-17-25)29-21-20-28(24-12-6-2-7-13-24)22-30(29)26-14-8-3-9-15-26/h1-22H
InChIKey IEHZGHBERIJKOB-UHFFFAOYSA-N
Molecular Weight 382.506 g/mol
SMILES C=1C(=CC=CC1)C1=CC=C(C2=C(C3=CC=CC=C3)C=C(C3=CC=CC=C3)C=C2)C=C1