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55362-80-6

9-溴-1-壬醇(55362-80-6)核磁图(13CNMR)

产品名称:9-溴-1-壬醇

CAS:55362-80-6

分子式:C9H19BrO

分子量: 223.15

InChI:InChI=1S/C9H19BrO/c10-8-6-4-2-1-3-5-7-9-11/h11H,1-9H2

InChIKey: USJDOLXCPFASNV-UHFFFAOYSA-N

Smiles:C(O)CCCCCCCCBr

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    Mass

    MS-IW-8668          
    9-bromo-1-nonanol
    C9H19BrO            (Mass of molecular ion:    222)
    

       Source Temperature: 210 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          17.0       1.0
          18.0       5.5
          27.0      11.8
          28.0       6.1
          29.0      14.8
          31.0      14.6
          32.0       1.2
          39.0      10.0
          40.0       2.1
          41.0      58.1
          42.0      17.4
          43.0      24.8
          44.0       2.6
          45.0       2.1
          53.0       4.6
          54.0      11.0
          55.0     100.0
          56.0      20.0
          57.0      14.3
          67.0      15.9
          68.0      22.3
          69.0      97.3
          70.0      17.8
          71.0       3.0
          73.0       1.9
          79.0       1.6
          80.0       1.2
          81.0      13.3
          82.0      19.7
          83.0      51.7
          84.0       4.6
          95.0       7.5
          96.0       5.5
          97.0      67.8
          98.0       5.8
         107.0       3.5
         109.0       3.5
         120.0       1.2
         121.0       1.6
         122.0       1.2
         123.0       1.2
         124.0       1.1
         125.0       1.7
         134.0       7.9
         135.0      34.7
         136.0       9.2
         137.0      33.4
         138.0       1.4
         148.0      23.0
         149.0       2.4
         150.0      22.3
         151.0       2.2
         162.0      13.7
         163.0       1.8
         164.0      13.3
         165.0       1.0
         176.0       7.7
         177.0       1.1
         178.0       7.3
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C9 H19 Br O 0.041 g : 0.5 ml CDCl3
    9-bromo-1-nonanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.632 B 3.410 C 1.96 D 1.854 E 1.563 F 1.41 G 1.31

         Hz     ppm     Int.
    

       1458.62   3.650    442
       1451.90   3.633    888
       1445.31   3.617    469
       1369.75   3.428    501
       1362.92   3.411   1000
       1356.08   3.394    532
        784.18   1.963    584
        755.00   1.890    105
        748.05   1.872    276
        740.97   1.855    304
        733.28   1.835    292
        726.44   1.818    129
        624.76   1.564    199
        617.80   1.546    171
        524.66   1.313    878
    

in CDCl3

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KBr disc

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nujol mull

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