Actidione(66-81-9) MS

Molecular FormulaC15H23NO4

Molecular Weight281.35

InChIInChI=1S/C15H23NO4/c1-8-3-9(2)15(20)11(4-8)12(17)5-10-6-13(18)16-14(19)7-10/h8-12,17H,3-7H2,1-2H3,(H,16,18,19)/t8-,9-,11-,12+/m0/s1

InChIKey YPHMISFOHDHNIV-FSZOTQKASA-N

SmilesN1C(=O)CC(C[C@H]([C@@H]2C[C@@H](C)C[C@H](C)C2=O)O)CC1=O

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Mass

MS-IW-2335          
cycloheximide
C15H23NO4           (Mass of molecular ion:    281)

   Source Temperature: 160 °C
   Sample Temperature: 180 °C
   Direct, 75 eV

      15.0       1.7
      17.0       1.0
      18.0       5.5
      26.0       1.6
      27.0      16.9
      28.0       8.8
      29.0      18.7
      30.0       1.0
      31.0       1.4
      38.0       2.1
      39.0      27.4
      40.0       6.9
      41.0      70.8
      42.0      49.1
      43.0      36.3
      44.0       9.8
      45.0       2.5
      50.0       1.5
      51.0       3.1
      52.0       1.9
      53.0      11.6
      54.0       4.9
      55.0      73.0
      56.0      31.1
      57.0      14.6
      58.0       2.1
      59.0      21.5
      60.0       4.0
      65.0       2.9
      66.0       2.6
      67.0      15.2
      68.0      10.9
      69.0      65.6
      70.0      17.1
      71.0       9.3
      72.0       2.7
      77.0       4.8
      78.0       1.2
      79.0       6.6
      80.0       2.1
      81.0      13.2
      82.0      44.8
      83.0      42.6
      84.0     100.0
      85.0      10.9
      86.0       7.6
      91.0       4.0
      93.0       8.8
      94.0      10.3
      95.0      14.7
      96.0       9.9
      97.0      16.8
      98.0      11.0
      99.0      21.2
     100.0       1.7
     105.0       1.7
     107.0       7.1
     108.0       5.2
     109.0      17.7
     110.0       6.5
     111.0      23.0
     112.0      33.4
     113.0       6.5
     114.0       2.1
     119.0       1.8
     120.0       1.1
     121.0       2.7
     122.0       3.6
     123.0       5.0
     124.0       2.9
     125.0      22.9
     126.0      64.3
     127.0      57.7
     128.0       5.0
     133.0       2.9
     134.0       2.2
     135.0       2.1
     136.0       1.3
     137.0       8.2
     138.0       5.7
     139.0       3.1
     140.0       1.1
     147.0       1.6
     148.0       1.2
     149.0       2.2
     150.0       3.7
     151.0      12.2
     152.0      13.0
     153.0       3.0
     154.0       1.9
     155.0       8.7
     156.0       2.8
     159.0       1.1
     161.0       1.9
     162.0       1.8
     163.0       2.8
     164.0       1.5
     165.0       1.4
     166.0       2.5
     168.0       3.0
     169.0       1.1
     170.0       1.7
     175.0       1.2
     176.0       5.1
     177.0       3.1
     186.0       1.2
     187.0       1.1
     189.0       1.6
     193.0       1.4
     203.0       1.3
     204.0       8.1
     205.0      11.5
     206.0       3.5
     217.0       1.1
     218.0       2.6
     219.0       1.3
     220.0       3.1
     221.0       2.5
     238.0       2.6
     245.0       1.9
     246.0       1.9
     248.0       2.1
     253.0       1.0
     263.0      36.9
     264.0       6.9
     281.0       1.5

KBr disc

nujol mull

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