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5332-25-2

6-溴喹啉(5332-25-2)核磁图(1HNMR)

产品名称:6-溴喹啉

CAS:5332-25-2

分子式:C9H6BrN

分子量: 208.05

InChI:InChI=1S/C9H6BrN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6H

InChIKey: IFIHYLCUKYCKRH-UHFFFAOYSA-N

Smiles:N1C2C(=CC(Br)=CC=2)C=CC=1

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    Mass

    MS-NW-6112          
    6-bromoquinoline
    C9H6BrN             (Mass of molecular ion:    207)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       2.4
          26.0       1.3
          27.0       1.5
          28.0       1.4
          37.0       2.5
          38.0       3.8
          39.0       2.8
          49.0       2.5
          49.5       1.4
          50.0      18.2
          50.5       2.2
          51.0      13.3
          52.0       2.7
          61.0       2.6
          62.0       5.0
          63.0       5.3
          63.5       2.0
          64.0      15.0
          64.5       1.4
          65.0       2.2
          73.0       2.0
          74.0      12.3
          75.0      18.5
          76.0       5.4
          77.0      12.2
          78.0       1.9
          86.0       1.1
          87.0       1.3
          88.0       1.0
          90.0       4.4
          91.0       4.6
          92.0       1.6
          98.0       2.7
          99.0       4.7
         100.0       7.1
         101.0      25.0
         102.0      10.2
         103.5       4.8
         104.5       4.8
         127.0       7.4
         128.0      78.0
         129.0       8.6
         143.0       1.0
         171.0       2.6
         173.0       2.5
         180.0       1.6
         181.0       1.1
         182.0       1.6
         206.0       1.5
         207.0     100.0
         208.0      11.4
         209.0      98.2
         210.0      10.1
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C9 H6 Br N 0.05 ml : 0.5 ml CDCl3
    6-bromoquinoline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.866 B 7.939 C 7.927 D 7.855 E 7.703 F 7.326

         Hz     ppm     Int.
    

       3546.39   8.874    617
       3544.56   8.870    629
       3542.11   8.864    631
       3540.41   8.859    620
       3177.86   7.952    461
       3176.88   7.950    418
       3176.15   7.948    440
       3172.97   7.940    737
       3169.80   7.932    483
       3168.09   7.928    468
       3164.06   7.918    834
       3140.38   7.858    957
       3138.18   7.853   1000
       3083.62   7.716    791
       3081.42   7.711    740
       3074.71   7.694    619
       3072.51   7.689    584
       2934.33   7.343    610
       2930.05   7.332    607
       2926.03   7.322    618
       2921.75   7.311    616
    

in CDCl3

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liquid film

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