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1722-26-5

三乙胺-硼烷(1722-26-5)核磁图(13CNMR)

产品名称:三乙胺-硼烷

CAS:1722-26-5

分子式:C6H18BN

分子量: 115.02

InChI:InChI=1S/C6H18BN/c1-4-8(7,5-2)6-3/h4-6H2,1-3,7H3

InChIKey: ONRDAGWFOUZNLV-UHFFFAOYSA-N

Smiles:[N+]([BH3-])(CC)(CC)CC

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    Mass

    MS-NW-8598          
    borane-triethylamine complex
    C6H15N H3B          (Mass of molecular ion:    115)
    

       Source Temperature: 260 °C
       Sample Temperature: 140 °C
       Reservoir, 75 eV
    

          13.0       1.3
          15.0       1.7
          18.0       1.8
          26.0       1.7
          27.0      11.2
          28.0      10.6
          29.0      15.9
          30.0      26.4
          39.0       1.3
          40.0       2.5
          41.0       3.1
          42.0      10.8
          43.0       1.7
          44.0      11.5
          53.0       1.9
          54.0       7.8
          55.0       1.5
          56.0       7.9
          57.0       1.8
          58.0      28.3
          59.0       1.0
          68.0       1.1
          69.0       1.4
          70.0       8.1
          71.0       1.5
          72.0       4.0
          81.0       1.4
          82.0       5.4
          83.0       3.9
          84.0      14.7
          85.0       1.5
          86.0     100.0
          87.0       6.0
          98.0       1.2
         100.0      12.5
         101.0      17.2
         102.0       1.3
         113.0       3.7
         114.0      15.0
         115.0       1.0
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H15 N 0.05 ml : 0.5 ml CDCl3
    borane-triethylamine complex
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.784 B 1.6 C 1.189

         Hz     ppm     Int.
    

       1123.78   2.812    227
       1116.46   2.794    531
       1109.13   2.776    543
       1101.81   2.757    237
        538.45   1.348     20
        482.91   1.209    697
        475.46   1.190   1000
        468.26   1.172    709
        454.10   1.137     28
        447.27   1.120     22
        446.90   1.119     22
        446.66   1.118     22
        444.70   1.113     21
    

in CDCl3

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liquid film

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