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5,5'-Di(4-biphenylyl)-2,2'-bithiophene
SpectraBase Compound ID 8HuZInwXbLu
InChI InChI=1S/C32H22S2/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-31(33-29)32-22-20-30(34-32)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H
InChIKey SJNXLFCTPWBYSE-UHFFFAOYSA-N
Mol Weight 470.6 g/mol
Molecular Formula C32H22S2
Exact Mass 470.116293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFO9cOWjVFD
Name 5,5'-di(4-Biphenylyl)-2,2'-bithiophene
Comments Computed using HOSE algorithm
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Exact Mass 470.116293056 u
Formula C32H22S2
InChI InChI=1S/C32H22S2/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-31(33-29)32-22-20-30(34-32)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H
InChIKey SJNXLFCTPWBYSE-UHFFFAOYSA-N
Molecular Weight 470.648 g/mol
SMILES C1(=CC=C(C=C1)C1=CC=C(S1)C=1SC(=CC1)C1=CC=C(C=C1)C1=CC=CC=C1)C1=CC=CC=C1