Benzenecarbothioic acid, S-phenyl ester(884-09-3) ¹³C NMR

Product NameBenzenecarbothioic acid, S-phenyl ester

CAS 884-09-3

Molecular FormulaC13H10OS

Molecular Weight214.28

InChIInChI=1S/C13H10OS/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H

InChIKey VCQYDZJGTXAFRL-UHFFFAOYSA-N

SmilesC1(C(SC2=CC=CC=C2)=O)=CC=CC=C1

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¹HNMR

¹³CNMR

    Assign.     Shift(ppm)

      A             8.034
      B             7.606
      C             7.52
      D             7.49
      E             7.46
      F             7.46

Spectral Code: 1H NMR : 400 MHz in CDCl3

       ppm   Int.  Assign.

      190.03   155      1
      136.80   163      2
      135.16   190      3
      135.07   781      4
      133.61   361      5
      129.50   397      6
      129.23   834      7 *
      128.74   782      8 *
      127.51  1000      9 *

Spectral Code: 13C NMR : in CDCl3

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Benzenecarbothioic acid, S-phenyl ester(884-09-3) 13C NMR

Benzenecarbothioic acid, S-phenyl ester(884-09-3) ¹³C NMR