BENZO[B]SELENOPHENE(272-30-0) ¹H NMR

Product NameBENZO[B]SELENOPHENE

CAS 272-30-0

Molecular FormulaC8H6Se

Molecular Weight181.09

InChIInChI=1S/C8H6Se/c1-2-4-8-7(3-1)5-6-9-8/h1-6H

InChIKey BNRDGHFESOHOBF-UHFFFAOYSA-N

Smiles[Se]1C=CC2=CC=CC=C12

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¹HNMR

    Parameter     ppm  Hz

      D(A)         7.90
      D(B)         7.50
      D(C)         7.76
      D(D)         7.29
      D(E)         7.19
      D(F)         7.86
       J(A,B)          5.77
       J(A,C)          0.0
       J(A,D)          0.0
       J(A,E)          0.0
       J(A,F)          0.0
       J(B,C)          0.14
       J(B,D)          0.0
       J(B,E)          0.0
       J(B,F)          0.65
       J(C,D)          7.97
       J(C,E)          1.02
       J(C,F)          0.48
       J(D,E)          7.22
       J(D,F)          1.17
       J(E,F)          8.27
     
     FALLER,P. & WEBER,J. BULL.SOC.CHIM.FR. 1972, 3193
     COUPLING CONSTANTS ARE TAKEN FROM : LLABRES,G. ET AL.
     TETRAHEDRON LETT. 31, 3177 (1972)

Spectral Code: 1H NMR : parameter in CDCl3

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BENZO[B]SELENOPHENE(272-30-0) ¹H NMR