481-29-8

表雄酮(481-29-8)質(zhì)譜(MS)

產(chǎn)品名稱:表雄酮

分子式:C19H30O2

分子量: 290.45

InChI:InChI=1/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,18-,19-/s3

InChIKey: QGXBDMJGAMFCBF-IMMPLFIYNA-N

Smiles:C[C@]12CC[C@H](O)C[C@]1([H])CC[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H] |&1:1,4,7,11,13,19,23,r|

Mass

MS-NW-9276          
3-epiandrosterone
C19H30O2            (Mass of molecular ion:    290)

   Source Temperature: 210 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      27.0       1.3
      29.0       3.3
      39.0       2.0
      41.0      10.2
      43.0       3.6
      53.0       3.6
      54.0       1.0
      55.0      10.4
      57.0       2.6
      65.0       1.7
      67.0      12.3
      68.0       2.6
      69.0       3.5
      77.0       4.6
      78.0       1.1
      79.0      11.3
      80.0       2.6
      81.0      11.2
      82.0       2.6
      83.0       2.2
      91.0       9.3
      92.0       2.3
      93.0      12.6
      94.0       5.1
      95.0       8.6
      96.0       2.0
      97.0       9.3
     105.0       8.6
     106.0       5.6
     107.0      21.8
     108.0      20.7
     109.0       8.9
     110.0       7.7
     111.0       2.3
     115.0       1.1
     117.0       1.8
     118.0       1.3
     119.0       6.4
     120.0       6.1
     121.0       8.1
     122.0       7.0
     123.0       5.7
     124.0      11.0
     125.0       2.4
     131.0       3.9
     132.0       1.5
     133.0       5.6
     134.0       4.5
     135.0       4.7
     136.0       4.8
     137.0       2.6
     138.0       1.5
     143.0       1.2
     144.0       1.1
     145.0       5.2
     146.0       4.3
     147.0      11.7
     148.0       5.7
     149.0       4.9
     150.0       1.9
     151.0       3.6
     152.0       1.1
     157.0       1.3
     158.0       1.3
     159.0       4.1
     160.0       3.4
     161.0       5.4
     162.0       2.7
     163.0       2.4
     164.0       7.0
     165.0       7.7
     166.0       3.0
     171.0       1.2
     173.0       3.6
     174.0       2.3
     175.0       3.1
     176.0       2.6
     177.0       2.0
     178.0       1.6
     187.0       2.5
     188.0       1.4
     189.0       1.9
     190.0       6.4
     191.0       2.4
     197.0       1.0
     199.0       2.0
     201.0       6.4
     202.0       1.6
     204.0       1.0
     213.0       8.4
     214.0       2.1
     215.0       9.8
     216.0       9.2
     217.0       5.0
     218.0       2.5
     219.0       3.7
     220.0       1.0
     228.0       5.0
     229.0       3.5
     230.0       2.5
     231.0       7.2
     232.0       2.8
     233.0       6.7
     234.0       5.5
     235.0       1.0
     239.0      10.2
     240.0       2.0
     244.0       2.4
     246.0      27.8
     247.0       6.4
     248.0       2.8
     254.0       7.8
     255.0       2.7
     257.0      13.4
     258.0       2.7
     272.0      15.0
     273.0       4.1
     274.0       1.3
     275.0      11.7
     276.0       2.3
     288.0       3.9
     289.0       1.2
     290.0     100.0
     291.0      20.9
     292.0       4.5