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51527-18-5

2-ACETYL-5-CHLORO-3-METHYLTHIANAPHTHENE

Product Name 2-ACETYL-5-CHLORO-3-METHYLTHIANAPHTHENE

CAS51527-18-5

MFC11H9ClOS

MW224.71

More

  • 51527-18-5_ms
    Mass

    MS-IW-2761          
    2-acetyl-5-chloro-3-methylbenzo(b)thiophene
    C11H9ClOS           (Mass of molecular ion:    224)
    

       Source Temperature: 190 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          31.0       1.0
          39.0       1.2
          43.0      10.4
          45.0       4.9
          50.0       1.2
          51.0       1.9
          62.0       1.2
          63.0       2.2
          69.0       5.0
          70.0       1.0
          72.0       1.1
          72.5       1.9
          73.0       2.7
          74.0       2.3
          75.0       3.4
          86.0       1.0
          87.0       1.7
          90.5       1.5
          93.0       1.7
          99.0       1.1
         101.0       4.3
         102.0       7.4
         103.0       1.0
         104.5       2.0
         112.0       2.0
         113.0       1.5
         115.0       1.5
         136.0       1.5
         137.0       1.8
         145.0      10.2
         146.0       7.9
         147.0       2.6
         149.0       2.7
         179.0       1.7
         180.0       1.0
         181.0      21.2
         182.0       2.7
         183.0       7.7
         209.0     100.0
         210.0      12.0
         211.0      36.7
         212.0       4.4
         213.0       1.7
         224.0      49.2
         225.0       6.6
         226.0      18.5
         227.0       2.4
    

400 MHz in DMSO-d6

  • 51527-18-5_1hnmr

    1H NMR 399.65 MHz
    C11 H9 Cl O S 0.039 g : 0.5 ml DMSO-d6
    2-acetyl-5-chloro-3-methylbenzo(b)thiophene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.04 B 8.03 C 7.544 D 2.667 E 2.627

         Hz     ppm     Int.
    

       3213.75   8.042    154
       3211.30   8.036    227
       3202.64   8.014    157
       3202.15   8.013    158
       3020.51   7.558    106
       3018.43   7.553    104
       3011.84   7.537    100
       3009.77   7.532     99
       1066.04   2.668    890
       1052.98   2.635     43
       1050.17   2.628   1000
    

in DMSO-d6

  • 51527-18-5_13cnmr

KBr disc

  • 51527-18-5_ir1_2

nujol mull

  • 51527-18-5_ir2