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306-07-0

优降宁盐酸盐(306-07-0)红外图谱(IR1)

产品名称:优降宁盐酸盐

CAS:306-07-0

分子式:C11H14ClN

分子量: 195.69

InChI:InChI=1S/C11H13N.ClH/c1-3-9-12(2)10-11-7-5-4-6-8-11;/h1,4-8H,9-10H2,2H3;1H

InChIKey: BCXCABRDBBWWGY-UHFFFAOYSA-N

Smiles:C1(=CC=CC=C1)CN(C)CC#C.Cl

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    Mass

    MS-NW-6663          
    N-methyl-N-(2-propynyl)benzylamine hydrochloride
    C11H13N HCl         (Mass of molecular ion:    159)
    

       Source Temperature: 160 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          15.0       5.3
          17.0       1.1
          18.0       5.3
          27.0       2.4
          28.0       2.7
          35.0       5.2
          36.0      38.0
          37.0       1.6
          38.0      12.4
          39.0      24.7
          40.0       2.4
          41.0      10.2
          42.0      52.0
          43.0       2.2
          44.0       3.8
          50.0       3.4
          51.0       8.3
          52.0       2.6
          53.0       1.0
          54.0       1.1
          55.0       1.0
          62.0       1.9
          63.0       5.9
          64.0       2.0
          65.0      24.4
          66.0       4.7
          68.0      73.7
          69.0       3.6
          75.0       1.0
          76.0       1.2
          77.0       5.7
          78.0       2.2
          78.5       1.6
          79.0       1.5
          80.0       3.4
          81.0       2.3
          82.0     100.0
          83.0       6.6
          89.0       5.4
          90.0       2.4
          91.0      84.8
          92.0      32.0
          93.0       1.9
         104.0       2.0
         115.0       3.8
         116.0       1.9
         117.0       2.1
         118.0      11.2
         119.0       2.0
         120.0       2.0
         128.0       1.3
         129.0       1.1
         132.0       6.2
         134.0       1.4
         143.0       1.1
         144.0       1.5
         157.0       1.5
         158.0      32.9
         159.0      64.8
         160.0       7.8
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C11 H13 N 0.033 g : 0.5 ml CDCl3
    N-methyl-N-(2-propynyl)benzylamine hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 13.0 B 7.717 C 7.44 D 4.34 E 3.87 F 2.890 G 2.858

         Hz     ppm     Int.
    

       3089.47   7.731    153
       3086.54   7.724    151
       3085.44   7.721    149
       3083.79   7.717    158
       3082.88   7.714    163
       3081.41   7.711    129
       3079.94   7.707    183
       3076.46   7.698     27
       3075.73   7.697     28
       2981.58   7.461     43
       2977.55   7.451    412
       2974.44   7.443    414
       2973.34   7.440    241
       2971.14   7.435    385
       2969.50   7.431    108
       2967.11   7.425     44
       1155.23   2.891   1000
       1144.97   2.865    164
       1142.41   2.859    348
       1139.84   2.853    163
    

in CDCl3

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KBr disc

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nujol mull

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4880 A,200 M,powder

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