6-溴喹啉(5332-25-2)核磁圖(¹HNMR)

產(chǎn)品名稱: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

¹HNMR

¹³CNMR

IR1

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

¹H NMR	399.65 MHz
C₉ H₆ Br N	0.05 ml : 0.5 ml CDCl₃
6-bromoquinoline

    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