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65016-55-9

3-癸基噻吩(65016-55-9)核磁图(13CNMR)

产品名称:3-癸基噻吩

CAS:65016-55-9

分子式:C14H24S

分子量: 224.41

InChI:InChI=1S/C14H24S/c1-2-3-4-5-6-7-8-9-10-14-11-12-15-13-14/h11-13H,2-10H2,1H3

InChIKey: JAYBIBLZTQMCAY-UHFFFAOYSA-N

Smiles:C1SC=CC=1CCCCCCCCCC

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    Mass

    MS-IW-3601          
    3-decylthiophene
    C14H24S             (Mass of molecular ion:    224)
    

       Source Temperature: 220 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          27.0       2.0
          29.0       3.5
          39.0       2.3
          41.0       6.6
          43.0       4.5
          45.0       3.9
          53.0       2.7
          55.0       2.8
          57.0       1.3
          67.0       1.2
          77.0       1.3
          84.0       1.3
          85.0       3.7
          97.0      46.7
          98.0     100.0
          99.0       9.8
         100.0       5.2
         110.0       1.4
         111.0      16.3
         112.0       2.0
         125.0       1.0
         139.0       1.9
         140.0       1.6
         224.0      14.3
         225.0       2.3
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C14 H24 S 0.05 ml : 0.5 ml CDCl3
    3-decylthiophene
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.202 B 6.915 C 6.891 D 2.607 E 1.606 F 1.32 G 1.30 J 1.28 K 1.26 L 0.879

         Hz     ppm     Int.
    

       2882.69   7.214    193
       2879.76   7.206    209
       2877.81   7.201    216
       2874.88   7.194    235
       2766.97   6.924    201
       2765.63   6.921    240
       2762.08   6.912    181
       2760.74   6.908    230
       2757.20   6.900    107
       2756.35   6.897    213
       2755.00   6.894    195
       2754.27   6.892    166
       2753.42   6.890    206
       2752.08   6.887    171
       2751.22   6.885     80
       1049.80   2.627    175
       1042.36   2.609    244
       1034.42   2.589    188
        649.90   1.627     83
        642.46   1.608    122
        635.01   1.589     96
        627.56   1.571     37
        519.90   1.301    357
        504.15   1.262   1000
        358.40   0.897    234
        351.56   0.880    729
        344.60   0.863    286
    

in CDCl3

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liquid film

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