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17356-19-3

乙烯基环戊醇(17356-19-3)质谱(MS)

产品名称:乙烯基环戊醇

CAS:17356-19-3

分子式:C7H10O

分子量: 110.15

InChI:InChI=1S/C7H10O/c1-2-7(8)5-3-4-6-7/h1,8H,3-6H2

InChIKey: LQMDOONLLAJAPZ-UHFFFAOYSA-N

Smiles:C1(C#C)(O)CCCC1

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    Mass

    MS-NW-9733          
    1-ethynylcyclopentanol
    C7H10O              (Mass of molecular ion:    110)
    

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

          18.0       1.9
          26.0       5.8
          27.0      15.1
          28.0       6.5
          29.0       5.8
          31.0       1.7
          37.0       1.2
          38.0       3.6
          39.0      37.5
          40.0      13.4
          41.0      21.9
          42.0       8.3
          43.0       9.1
          50.0       4.2
          51.0      10.4
          52.0       3.0
          53.0      37.1
          54.0      29.3
          55.0      56.0
          56.0       4.5
          57.0       1.5
          61.0       1.0
          62.0       2.4
          63.0       5.3
          64.0       6.4
          65.0       8.0
          66.0       5.5
          67.0      56.3
          68.0      84.1
          69.0       9.8
          70.0       2.3
          71.0       2.8
          77.0      11.1
          78.0       1.7
          79.0      11.6
          80.0       2.1
          81.0     100.0
          82.0      33.4
          83.0       5.7
          84.0       3.8
          91.0      19.6
          92.0       4.6
          93.0       4.2
          94.0       1.2
          95.0      56.0
          96.0       3.7
         107.0       1.3
         109.0      28.3
         110.0       3.9
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C7 H10 O 0.05 ml : 0.5 ml CDCl3
    1-ethynylcyclopentanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.81 B 2.503 C 1.962 D *1 1.84 E *1 1.73

         Hz     ppm     Int.
    

       1124.27   2.814     86
       1000.37   2.504   1000
        796.75   1.994     36
        791.50   1.981    299
        789.67   1.976    227
        784.91   1.964    583
        782.59   1.959    257
        779.91   1.952    400
        777.59   1.946    427
        773.07   1.935     58
        771.85   1.932     49
        752.69   1.884     34
        750.98   1.880     34
        745.97   1.867     31
        743.90   1.862     76
        741.58   1.856     86
        739.75   1.851    111
        737.30   1.845    145
        736.57   1.844    166
        732.54   1.833    150
        731.81   1.832    149
        728.39   1.823    129
        727.91   1.822    130
        724.85   1.814    123
        723.39   1.811    116
        721.92   1.807     79
        720.34   1.803     79
        717.77   1.796     35
        716.43   1.793     44
        714.60   1.789     66
        712.77   1.784     61
        711.55   1.781     50
        709.59   1.776     45
        709.23   1.775     45
        707.76   1.771     81
        703.98   1.762     77
        701.54   1.756     88
        699.10   1.750    159
        697.39   1.746    135
        694.95   1.739    139
        691.65   1.731    187
        687.74   1.721    136
        686.40   1.718    126
        684.33   1.713     99
        683.11   1.710     77
        680.54   1.703     67
        675.17   1.690     32
    

in CDCl3

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liquid film

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