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394-25-2

4-METHOXY-3-NITROBENZOTRIFLUORIDE

Product Name 4-METHOXY-3-NITROBENZOTRIFLUORIDE

CAS394-25-2

MFC8H6F3NO3

MW221.13

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  • 394-25-2_ms
    Mass

    MS-NW-8792          
    2-nitro-4-(trifluoromethyl)anisole
    C8H6F3NO3           (Mass of molecular ion:    221)
    

       Source Temperature: 270 °C
       Sample Temperature: 120 °C
       Reservoir, 75 eV
    

          15.0       2.7
          28.0       3.3
          29.0       2.0
          30.0       8.8
          31.0       7.7
          37.0       1.5
          38.0       2.4
          39.0       1.9
          50.0       7.9
          51.0       6.2
          53.0       4.2
          56.0       1.0
          57.0       4.6
          61.0       2.2
          62.0       7.3
          63.0      32.7
          64.0       2.5
          65.0       1.2
          68.0       1.2
          69.0       6.4
          70.0       1.5
          74.0       5.1
          75.0      16.3
          76.0       4.9
          77.0       3.7
          78.0       2.4
          79.0       1.8
          81.0       6.5
          82.0       3.0
          83.0       3.3
          87.0       1.5
          88.0       1.8
          93.0       1.7
          94.0       3.8
          95.0      18.4
          96.0       3.3
          99.0       2.5
         100.0       1.4
         101.0       2.9
         106.0       1.9
         107.0       3.6
         110.0       3.4
         112.0       3.7
         113.0      10.5
         114.0       2.0
         115.0       3.4
         119.0       3.2
         120.0       6.7
         123.0       1.4
         125.0      12.1
         126.0      23.0
         127.0      15.6
         128.0       1.7
         129.0       1.4
         131.0       1.5
         132.0      33.7
         133.0       9.9
         141.0      13.5
         142.0       1.7
         143.0       8.6
         144.0       4.2
         145.0      84.7
         146.0      28.1
         147.0       9.5
         148.0       6.7
         149.0       1.2
         159.0       1.2
         160.0      65.3
         161.0      46.8
         162.0       6.0
         163.0      22.3
         164.0       2.8
         174.0     100.0
         175.0       9.7
         176.0       1.7
         177.0       1.1
         188.0       1.1
         191.0      73.6
         192.0      10.7
         202.0      19.2
         203.0       1.8
         205.0       1.1
         207.0       3.4
         221.0      62.8
         222.0       6.5
    

90 MHz in CDCl3

  • 394-25-2_1hnmr

    1H NMR 89.56 MHz
    C8 H6 F3 N O3 0.05 g : 0.5 ml CDCl3
    2-nitro-4-(trifluoromethyl)anisole
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.113 B 7.81 C 7.250 D 4.045

         Hz     ppm     Int.
    

        727.81   8.127     98
        725.63   8.103    106
        705.81   7.881     54
        705.25   7.875     52
        704.19   7.863     37
        703.50   7.856     44
        703.00   7.850     39
        697.00   7.783     71
        696.44   7.777     68
        695.50   7.766     48
        694.69   7.757     61
        694.06   7.750     52
        652.50   7.286    141
        643.75   7.188     73
        368.06   4.110     24
        362.31   4.046   1000
    

in CDCl3

  • 394-25-2_13cnmr

KBr disc

  • 394-25-2_ir1_2

liquid film

  • 394-25-2_ir2