502-72-7

环十五烷酮(502-72-7)红外图谱(IR2)

产品名称:环十五烷酮

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

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

¹H NMR	89.56 MHz
C₁₅ H₂₈ O	0.027 g : 0.5 ml CDCl₃
cyclopentadecanone

    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