1250-95-9

胆固醇-5Α,6Α-环氧化物(1250-95-9)质谱(MS)

分子式:C27H46O2

分子量: 402.65

InChI:InChI=1/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24+,25-,26-,27+/s3

InChIKey: PRYIJAGAEJZDBO-BKVPMDHRNA-N

Smiles:[C@]123C[C@H](CC[C@]1(C)[C@@]1([H])CC[C@]4(C)[C@H](CC[C@@]4([H])[C@]1([H])C[C@@H]2O3)[C@H](C)CCCC(C)C)O |&1:0,2,5,7,11,13,16,18,21,23,r|

Mass

MS-IW-2135          
5,6alpha-epoxy-5alpha-cholestan-3beta-ol
C27H46O2            (Mass of molecular ion:    402)

   Source Temperature: 180 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      17.0       1.7
      18.0       8.6
      27.0       3.7
      28.0       1.8
      29.0      12.2
      39.0       3.5
      40.0       1.0
      41.0      36.1
      42.0       3.4
      43.0      57.3
      44.0       2.3
      45.0       1.0
      53.0       6.6
      54.0       1.8
      55.0      55.2
      56.0       5.2
      57.0      40.3
      58.0       2.1
      65.0       2.9
      66.0       2.0
      67.0      31.0
      68.0       9.8
      69.0      34.9
      70.0       3.7
      71.0      20.3
      72.0       1.4
      77.0       9.7
      78.0       2.4
      79.0      27.9
      80.0       7.1
      81.0      52.6
      82.0      11.2
      83.0      24.1
      84.0       2.9
      85.0       6.1
      91.0      23.6
      92.0       7.3
      93.0      45.5
      94.0      20.7
      95.0      62.0
      96.0      12.3
      97.0      15.5
      98.0       1.9
      99.0       1.9
     103.0       1.4
     104.0       1.5
     105.0      27.7
     106.0       9.6
     107.0      43.5
     108.0      26.0
     109.0      35.9
     110.0      10.0
     111.0      14.1
     112.0       2.0
     113.0       2.3
     114.0      14.6
     115.0       3.1
     116.0       1.4
     117.0       7.5
     118.0      13.3
     119.0      22.3
     120.0      48.1
     121.0      37.2
     122.0      41.6
     123.0      43.3
     124.0       9.6
     125.0       5.6
     126.0       1.7
     127.0       2.7
     128.0       9.4
     129.0       5.2
     130.0       2.6
     131.0      14.1
     132.0       5.7
     133.0      27.6
     134.0      18.4
     135.0      44.6
     136.0      22.9
     137.0      13.2
     138.0       7.9
     139.0       8.8
     140.0      13.1
     141.0      23.2
     142.0       4.7
     143.0       9.8
     144.0       5.3
     145.0      17.9
     146.0       6.5
     147.0      19.3
     148.0      10.7
     149.0      43.4
     150.0       9.6
     151.0      16.1
     152.0       6.9
     153.0       2.9
     154.0       6.0
     155.0       3.7
     156.0       3.0
     157.0      11.2
     158.0       9.2
     159.0      17.4
     160.0       6.5
     161.0      19.3
     162.0       7.9
     163.0      24.8
     164.0      11.5
     165.0       6.7
     166.0       1.9
     167.0       1.9
     168.0       1.2
     169.0       3.3
     170.0       2.1
     171.0       7.7
     172.0       3.9
     173.0      11.6
     174.0       5.0
     175.0      16.7
     176.0       7.1
     177.0      12.1
     178.0       4.5
     179.0       5.7
     180.0       3.1
     181.0       2.2
     182.0       1.0
     183.0       4.0
     184.0       2.0
     185.0       8.8
     186.0       3.7
     187.0       9.1
     188.0       3.1
     189.0       7.3
     190.0       6.9
     191.0       9.5
     192.0       3.7
     193.0      12.2
     194.0       4.0
     195.0       1.9
     196.0       1.0
     197.0       5.3
     198.0       2.4
     199.0       8.4
     200.0       3.3
     201.0       9.0
     202.0       3.0
     203.0       8.4
     204.0       3.3
     205.0       5.3
     206.0      10.4
     207.0       5.1
     208.0       1.3
     209.0       1.0
     211.0      15.7
     212.0       5.1
     213.0       7.4
     214.0       2.2
     215.0       7.5
     216.0       4.3
     217.0      12.2
     218.0       4.4
     219.0       8.8
     220.0       4.3
     221.0       1.5
     225.0       3.0
     226.0       4.0
     227.0      11.9
     228.0       3.1
     229.0      15.0
     230.0       6.1
     231.0       8.0
     232.0       3.2
     233.0       7.1
     234.0       3.2
     235.0       1.8
     239.0       1.6
     241.0       1.1
     243.0       5.3
     244.0       5.5
     245.0      17.2
     246.0       8.5
     247.0      25.3
     248.0       9.8
     249.0       8.0
     250.0       1.8
     251.0       1.8
     253.0      10.9
     254.0       2.6
     255.0       2.9
     256.0       1.0
     257.0       2.3
     258.0       1.5
     259.0       4.0
     260.0       5.0
     261.0      21.6
     262.0      10.3
     263.0       4.1
     264.0       3.5
     265.0       1.0
     269.0       1.8
     270.0       1.8
     271.0      20.2
     272.0       5.1
     273.0       6.9
     274.0       6.0
     275.0      11.8
     276.0       4.4
     277.0       2.7
     281.0       1.2
     285.0       1.2
     286.0       1.1
     287.0       3.3
     288.0       7.8
     289.0      12.1
     290.0       5.4
     291.0       6.5
     292.0       1.5
     299.0       3.7
     300.0       1.9
     301.0       4.1
     302.0       1.8
     303.0       4.9
     304.0       2.5
     311.0       1.1
     313.0       2.5
     314.0       1.7
     315.0       1.9
     316.0       1.1
     317.0       3.3
     318.0       1.8
     325.0       2.7
     326.0       3.5
     327.0       3.6
     328.0       1.8
     329.0       3.9
     330.0       2.7
     331.0      29.9
     332.0       8.3
     333.0       1.4
     340.0       3.5
     341.0       4.3
     342.0       3.0
     343.0       3.9
     344.0       2.5
     345.0       3.6
     346.0       1.3
     351.0      14.1
     352.0       4.5
     353.0       2.5
     355.0       4.0
     356.0       5.2
     357.0       2.8
     358.0      23.9
     359.0       9.8
     360.0       2.1
     366.0      18.9
     367.0       6.9
     368.0       5.5
     369.0      26.3
     370.0       8.2
     371.0       4.1
     372.0       1.6
     373.0       2.7
     374.0       2.5
     382.0       2.1
     383.0       1.5
     384.0      78.8
     385.0      24.7
     386.0       9.5
     387.0       9.7
     388.0       5.0
     389.0       1.3
     400.0       8.5
     401.0       2.4
     402.0     100.0
     403.0      30.1
     404.0       5.0