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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>114971-52-7更多圖譜> 芐基三甲基二氯碘酸銨(114971-52-7)紅外圖譜(IR2)

114971-52-7

芐基三甲基二氯碘酸銨(114971-52-7)紅外圖譜(IR2)

分子式:C10H16Cl2IN

分子量: 348.05

InChI:InChI=1S/C10H16N.Cl2I/c1-11(2,3)9-10-7-5-4-6-8-10;1-3-2/h4-8H,9H2,1-3H3;/q+1;-1

InChIKey: PPDJNZTUDFPAHX-UHFFFAOYSA-N

Smiles:C1(C[N+](C)(C)C)=CC=CC=C1.[I-](Cl)Cl

  • 圖譜
    Mass

    MS-IW-5566          
    benzyltrimethylammonium dichloroiodate
    C10H16Cl2IN         (Mass of molecular ion:    347)
    

       Source Temperature: 200 °C
       Sample Temperature: 230 °C
       Direct, 75 eV
    

          15.0       2.4
          28.0       2.6
          29.0       1.4
          30.0       7.2
          36.0       3.6
          38.0       1.9
          39.0       5.0
          40.0       1.0
          41.0       1.9
          42.0       9.0
          43.0       3.0
          44.0       4.5
          45.0       3.7
          45.5       1.1
          50.0       6.4
          51.0       3.3
          52.0       2.0
          56.0       1.0
          57.0       3.2
          58.0      58.4
          59.0      15.8
          62.0       1.7
          63.0       5.5
          64.0       1.4
          65.0      12.7
          77.0       1.1
          89.0       4.9
          90.0       2.0
          91.0     100.0
          92.0       9.8
         118.0       1.1
         125.0       2.2
         126.0      18.4
         127.0       2.3
         128.0       6.2
         134.0       9.4
         135.0      12.3
         136.0       1.2
    

400 MHz in DMSO-d6

  • 圖譜

    1H NMR 399.65 MHz
    C10 H16 Cl2 I N 0.039 g : 0.5 ml DMSO-d6
    benzyltrimethylammonium dichloroiodate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.55 B 4.526 C 3.034

         Hz     ppm     Int.
    

       3020.87   7.559     28
       3018.31   7.553    101
       3016.97   7.550    139
       3015.38   7.546    532
       3012.57   7.539     68
       3011.47   7.536     42
       3010.62   7.534     34
       1808.96   4.527    246
       1212.65   3.035   1000
    

in DMSO-d6

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

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