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20098-14-0

5-羟基-2-金刚烷酮(20098-14-0)核磁图(13CNMR)

分子式:C10H14O2

分子量: 166.22

InChI:InChI=1S/C10H14O2/c11-9-7-1-6-2-8(9)5-10(12,3-6)4-7/h6-8,12H,1-5H2

InChIKey: TZBDEVBNMSLVKT-UHFFFAOYSA-N

Smiles:C12CC3(O)CC(CC(C3)C1=O)C2

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    Mass

    MS-KW-0808          
    5-hydroxy-2-adamantanone
    C10H14O2            (Mass of molecular ion:    166)
    

       Source Temperature: 250 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       2.7
          27.0       8.7
          28.0       2.7
          29.0       3.5
          31.0       1.3
          39.0      11.0
          40.0       2.6
          41.0      16.8
          42.0       2.9
          43.0       9.2
          51.0       2.3
          52.0       1.1
          53.0       5.2
          54.0       2.1
          55.0      15.7
          56.0       1.5
          57.0       2.0
          60.0       1.2
          65.0       2.7
          66.0       2.5
          67.0       9.6
          68.0       4.6
          69.0       4.5
          70.0       5.0
          71.0       1.8
          72.0       2.7
          77.0       6.7
          78.0       2.4
          79.0      10.3
          80.0       9.1
          81.0       5.9
          82.0       4.6
          83.0       6.8
          84.0       1.3
          91.0       5.0
          92.0       2.0
          93.0       2.5
          94.0      11.5
          95.0     100.0
          96.0      21.2
          97.0      10.5
          98.0       1.0
         105.0       2.2
         106.0       7.1
         107.0       6.1
         108.0      20.6
         109.0       7.0
         110.0       4.8
         111.0       2.9
         120.0       1.7
         121.0       2.9
         123.0       4.1
         124.0       1.3
         133.0       2.8
         137.0       1.0
         138.0       3.8
         148.0      10.8
         149.0       1.4
         151.0       1.5
         164.0       1.2
         166.0      35.0
         167.0       4.1
    

in CDCl3

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KBr disk

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Nujol

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