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返回ChemicalBook首页>CAS数据库列表>62454-83-5更多图谱> 3-[(p-nitrophenyl)hydrazono]butan-2-one oxime (62454-83-5)核磁图(1HNMR)

62454-83-5

3-[(p-nitrophenyl)hydrazono]butan-2-one oxime (62454-83-5)核磁图(1HNMR)

分子式:C10H12N4O3

分子量: 236.23

InChI:InChI=1S/C10H12N4O3/c1-7(8(2)13-15)11-12-9-3-5-10(6-4-9)14(16)17/h3-6,12,15H,1-2H3

InChIKey: FOJBDPWRVOUZOL-UHFFFAOYSA-N

Smiles:CC(=NNC1=CC=C([N+]([O-])=O)C=C1)C(=NO)C

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    Mass

    MS-NW-6908          
    biacetyl mono(p-nitrophenylhydrazone) monooxime
    C10H12N4O3          (Mass of molecular ion:    236)
    

       Source Temperature: 230 °C
       Sample Temperature: 170 °C
       Direct, 75 eV
    

          15.0      15.4
          17.0       2.4
          18.0       9.7
          26.0       1.8
          27.0       7.9
          28.0       9.5
          29.0       1.6
          30.0      74.7
          31.0       4.9
          37.0       1.6
          38.0       6.4
          39.0      13.3
          40.0       6.4
          41.0      14.9
          42.0      44.8
          43.0       8.4
          44.0       3.0
          50.0       8.1
          51.0       6.6
          52.0      11.2
          53.0       7.7
          54.0       4.0
          55.0       2.5
          57.0       1.4
          58.0      11.6
          61.0       1.0
          62.0       5.0
          63.0      26.1
          64.0      25.7
          65.0       9.9
          66.0       1.9
          67.0       1.4
          68.0       8.0
          69.0       6.8
          70.0       4.7
          74.0       2.3
          75.0       8.3
          76.0      10.7
          77.0       4.3
          78.0       4.6
          79.0      10.3
          80.0       9.2
          81.0       3.6
          82.0       1.0
          83.0       4.1
          84.0       3.2
          88.0       1.0
          89.0       5.2
          90.0      31.5
          91.0      22.4
          92.0      10.5
          93.0       2.1
          98.0       1.1
          99.0       2.1
         100.0       1.4
         102.0       1.3
         103.0       1.8
         104.0       2.8
         105.0       6.7
         106.0      17.2
         107.0       4.8
         108.0       8.9
         109.0       1.0
         116.0       1.0
         117.0       1.9
         118.0       1.5
         119.0       1.3
         120.0       3.2
         121.0       1.7
         122.0      23.1
         123.0       2.2
         130.0       1.2
         131.0       5.6
         132.0       6.7
         133.0       1.5
         135.0       1.0
         136.0      25.1
         137.0       8.9
         138.0      15.6
         139.0       3.1
         143.0       1.1
         144.0       1.5
         145.0       1.7
         146.0       1.1
         147.0       3.0
         150.0       9.8
         151.0      14.5
         152.0       3.2
         156.0       1.5
         157.0       1.0
         158.0       1.2
         161.0       2.7
         162.0       1.3
         163.0       1.2
         172.0       4.3
         173.0      25.2
         174.0       3.6
         177.0       8.4
         178.0       2.7
         188.0      12.9
         189.0       3.2
         190.0       1.4
         202.0       5.3
         203.0       2.4
         204.0       2.3
         206.0       1.3
         218.0      17.6
         219.0      77.3
         220.0      14.6
         221.0       2.2
         234.0       4.2
         235.0       2.5
         236.0     100.0
         237.0      15.3
         238.0       2.3
    

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C10 H12 N4 O3 0.036 g : 0.5 ml DMSO-d6
    biacetyl mono(p-nitrophenylhydrazone) monooxime
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 11.4 B *1 10.2 C 8.143 D 7.324 E *2 2.153 F *2 2.082

         Hz     ppm     Int.
    

       4577.14  11.453    184
       4095.24  10.248    153
       3259.45   8.156    272
       3250.11   8.133    280
       2934.69   7.344     34
       2931.76   7.336    233
       2927.18   7.325     22
       2922.42   7.313    223
       2919.49   7.306     31
        860.52   2.154    940
        832.13   2.083   1000
    

in DMSO-d6

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KBr disc

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nujol mull

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