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294-62-2

環(huán)十二烷(294-62-2)質(zhì)譜(MS)

產(chǎn)品名稱:環(huán)十二烷

CAS:294-62-2

分子式:C12H24

分子量: 168.32

InChI:InChI=1S/C12H24/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-12H2

InChIKey: DDTBPAQBQHZRDW-UHFFFAOYSA-N

Smiles:C1CCCCCCCCCCC1

  • 圖譜
    Mass 

    MS2016-05363CM      
cyclododecane
C12H24              (Mass of molecular ion:    168)


       Source Temperature: 250 °C
   Sample Temperature:  20 °C
   Direct, 70 eV


          27.0      11.3
      28.0       4.7
      29.0      20.4
      39.0      15.0
      40.0       3.0
      41.0      68.4
      42.0      23.7
      43.0      44.6
      44.0       1.5
      53.0       6.3
      54.0      10.6
      55.0     100.0
      56.0      70.6
      57.0      44.5
      58.0       1.9
      65.0       1.1
      66.0       1.3
      67.0      15.1
      68.0      29.3
      69.0      88.8
      70.0      68.4
      71.0      16.4
      79.0       1.1
      81.0       6.5
      82.0      38.2
      83.0      86.2
      84.0      45.1
      85.0      10.9
      95.0       1.9
      96.0      17.4
      97.0      63.9
      98.0      29.7
      99.0       3.0
     110.0       7.2
     111.0      39.5
     112.0      18.0
     113.0       1.8
     124.0       2.8
     125.0      17.8
     126.0       9.0
     138.0       1.1
     139.0       5.1
     140.0      18.5
     141.0       2.0
     168.0      34.2
     169.0       4.5

in CDCl3

parameter in CDCl3

  • 圖譜

  • 圖譜

    1H NMR 300 MHz
    C12 H24 0.047 g : 0.5 ml CDCl3
    cyclododecane
    ChemicalStructure 
        Parameter     ppm  Hz
    
      D(A)         1.341
  

         Hz     ppm     Int.


        402.30   1.341   1000

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

4880 A,200 M,powder

  • 圖譜

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