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502-72-7

環(huán)十五烷酮(502-72-7)紅外圖譜(IR2)

產(chǎn)品名稱(chēng):環(huán)十五烷酮

CAS:502-72-7

分子式:C15H28O

分子量: 224.38

InChI:InChI=1S/C15H28O/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-15/h1-14H2

InChIKey: OSOIQJGOYGSIMF-UHFFFAOYSA-N

Smiles:C1(=O)CCCCCCCCCCCCCC1

  • 圖譜
    Mass

    MS-NW-6915          
    cyclopentadecanone
    C15H28O             (Mass of molecular ion:    224)
    

       Source Temperature: 270 °C
       Sample Temperature: 200 °C
       Reservoir, 75 eV
    

          15.0       1.1
          18.0       1.2
          26.0       1.0
          27.0      23.2
          28.0      11.4
          29.0      35.4
          30.0       1.1
          31.0       1.3
          39.0      24.0
          40.0       5.9
          41.0     100.0
          42.0      25.7
          43.0      35.4
          44.0       1.7
          51.0       1.5
          52.0       1.2
          53.0      10.8
          54.0       9.4
          55.0      77.2
          56.0      17.0
          57.0      13.5
          58.0      33.6
          59.0      13.7
          65.0       2.2
          66.0       1.8
          67.0      15.5
          68.0      10.9
          69.0      25.1
          70.0      10.6
          71.0      37.4
          72.0       4.3
          77.0       1.9
          78.0       1.3
          79.0       5.9
          80.0       7.7
          81.0      13.6
          82.0      15.1
          83.0      17.0
          84.0      11.5
          85.0       6.9
          86.0       1.2
          91.0       1.0
          93.0       4.1
          94.0       7.3
          95.0       9.6
          96.0      15.0
          97.0      13.4
          98.0      13.1
          99.0       2.5
         100.0       2.1
         107.0       3.2
         108.0       5.4
         109.0       5.1
         110.0       7.9
         111.0       9.9
         112.0       3.2
         113.0       2.2
         114.0       2.0
         121.0       5.0
         122.0       3.6
         123.0       3.0
         124.0       5.9
         125.0       9.4
         126.0       1.7
         127.0       2.3
         128.0       1.9
         135.0       5.7
         136.0       2.6
         137.0       2.0
         138.0       3.0
         139.0       2.3
         141.0       1.1
         142.0       2.1
         149.0       3.3
         150.0       1.8
         153.0       1.1
         156.0       1.3
         163.0       1.8
         164.0       3.1
         166.0       5.0
         167.0       1.8
         177.0       1.3
         181.0       1.4
         206.0       2.9
         209.0       1.3
         224.0      10.2
         225.0       2.4
    

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C15 H28 O 0.027 g : 0.5 ml CDCl3
    cyclopentadecanone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.367 B 1.59 C 1.25

         Hz     ppm     Int.
    

        218.31   2.438     56
        212.00   2.368    120
        205.13   2.291     91
        148.94   1.664     35
        142.13   1.587     53
        139.75   1.561     30
        139.44   1.557     29
        138.38   1.546     29
        135.94   1.518     40
        121.13   1.353     22
        111.75   1.248   1000
        100.69   1.125     29
         99.75   1.114     25
    

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

4880 A,200 M,powder

  • 圖譜

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