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Back ChemicalBook Home>CAS DataBase List>50-04-4More Spectrum> Cortisone acetate(50-04-4) IR2

Cortisone acetate(50-04-4) IR2

Product NameCortisone acetate

CAS50-04-4

Molecular FormulaC23H30O6

Molecular Weight402.48

InChIInChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-17,20,28H,4-9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1

InChIKey ITRJWOMZKQRYTA-RFZYENFJSA-N

SmilesC1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1=O)(C)[C@@](O)(C(=O)COC(C)=O)CC3)CC2


  • Mass

    MS2004-02326WA      
    21-acetoxy-17alpha-hydroxy-4-pregnene-3,11,20-trione
    C23H30O6            (Mass of molecular ion:    402)
    

       Source Temperature: 250 °C
       Sample Temperature: 170 °C
       Direct, 70 eV
    

          15.0       1.2
          27.0       2.0
          28.0       3.1
          29.0       5.5
          30.0       1.7
          31.0       1.6
          39.0       4.1
          40.0       1.1
          41.0      15.9
          42.0       4.3
          43.0      87.1
          44.0       2.1
          45.0       1.1
          51.0       1.3
          52.0       1.0
          53.0       8.1
          54.0       1.2
          55.0      14.0
          57.0       2.4
          60.0       1.2
          65.0       5.7
          66.0       2.3
          67.0      13.0
          68.0       3.4
          69.0       7.7
          70.0       1.2
          71.0       2.4
          73.0       2.7
          74.0       1.9
          77.0      18.5
          78.0       4.9
          79.0      23.4
          80.0       3.7
          81.0      11.5
          82.0       2.1
          83.0       5.1
          85.0       1.2
          87.0       2.7
          91.0      39.6
          92.0       6.3
          93.0      19.3
          94.0       4.2
          95.0      11.6
          96.0       4.4
          97.0      12.4
          98.0       1.3
          99.0       1.9
         101.0       1.2
         102.0       1.4
         103.0       5.1
         104.0       2.9
         105.0      30.4
         106.0       6.9
         107.0      19.5
         108.0       7.2
         109.0      16.1
         110.0       6.0
         111.0       4.8
         115.0       6.8
         116.0       3.4
         117.0      12.5
         118.0       4.1
         119.0      17.7
         120.0       7.5
         121.0      67.6
         122.0     100.0
         123.0      37.2
         124.0      12.6
         125.0       3.6
         126.0       1.2
         127.0       2.3
         128.0       5.7
         129.0       9.1
         130.0       3.9
         131.0      13.6
         132.0       4.2
         133.0      21.7
         134.0      16.9
         135.0      34.4
         136.0      39.0
         137.0      14.1
         138.0       2.8
         139.0       4.2
         141.0       3.5
         142.0       2.9
         143.0       9.7
         144.0       4.6
         145.0      15.9
         146.0       8.9
         147.0      33.7
         148.0      14.3
         149.0      16.4
         150.0       5.1
         151.0       3.5
         152.0       1.8
         153.0       2.4
         154.0       1.2
         155.0       4.0
         156.0       2.0
         157.0       6.9
         158.0       4.0
         159.0      18.2
         160.0      11.5
         161.0      41.3
         162.0      16.9
         163.0      40.6
         164.0       6.8
         165.0       5.2
         166.0       3.1
         167.0       2.5
         168.0       1.5
         169.0       4.2
         170.0       2.4
         171.0       8.6
         172.0       5.6
         173.0      16.0
         174.0       8.5
         175.0      13.1
         176.0       4.6
         177.0      12.3
         178.0       3.9
         179.0       8.2
         180.0       1.9
         181.0       3.2
         182.0       1.7
         183.0       5.9
         184.0       3.1
         185.0       8.0
         186.0       6.1
         187.0      12.2
         188.0       7.8
         189.0      18.8
         190.0       5.6
         191.0       7.4
         192.0       3.2
         193.0       3.1
         194.0       1.9
         195.0       9.5
         196.0       3.0
         197.0       8.2
         198.0       3.8
         199.0       7.8
         200.0       4.4
         201.0       9.5
         202.0       8.9
         203.0       6.0
         204.0       3.2
         205.0       3.5
         206.0       1.4
         207.0       4.6
         208.0       2.3
         209.0       5.1
         210.0       2.7
         211.0       7.0
         212.0       3.6
         213.0       9.1
         214.0       5.8
         215.0      10.8
         216.0       4.3
         217.0       2.7
         218.0       2.0
         219.0       2.9
         220.0       2.9
         221.0       4.5
         222.0       2.1
         223.0       8.6
         224.0       3.3
         225.0      15.5
         226.0       5.8
         227.0       8.2
         228.0       5.8
         229.0       9.0
         230.0       7.9
         231.0       5.0
         232.0       1.6
         233.0       1.2
         235.0       2.5
         236.0       1.6
         237.0       7.3
         238.0      10.1
         239.0      13.1
         240.0       5.4
         241.0      17.0
         242.0       7.9
         243.0      23.7
         244.0      28.7
         245.0      10.1
         246.0       2.7
         247.0       1.5
         249.0       1.8
         250.0       2.1
         251.0       5.7
         252.0       2.2
         253.0       7.1
         254.0       5.0
         255.0      40.4
         256.0      32.5
         257.0      52.6
         258.0      23.4
         259.0      10.2
         260.0       2.0
         261.0       1.3
         263.0       3.8
         264.0       1.8
         265.0       5.8
         266.0       2.8
         267.0       4.1
         268.0       3.5
         269.0       4.3
         270.0       1.8
         271.0       4.9
         272.0      56.6
         273.0      19.1
         274.0       5.8
         275.0       1.5
         277.0       1.0
         278.0       1.8
         279.0       2.0
         281.0      10.7
         282.0       4.7
         283.0      10.4
         284.0       4.2
         285.0       6.2
         286.0       6.5
         287.0       3.6
         288.0       1.0
         291.0       1.5
         294.0       2.0
         295.0       2.0
         296.0       8.8
         297.0       7.8
         298.0       2.8
         299.0      15.4
         300.0      19.5
         301.0      57.7
         302.0      14.2
         303.0       2.6
         306.0       1.1
         309.0       7.6
         310.0       2.0
         311.0       3.8
         312.0       7.2
         313.0       8.0
         314.0      23.3
         315.0      28.8
         316.0       6.0
         317.0       2.5
         324.0       9.4
         325.0       3.0
         326.0       2.0
         327.0       8.1
         328.0       3.3
         329.0       2.7
         330.0      24.5
         331.0       6.4
         332.0       5.5
         333.0       1.1
         341.0       1.0
         342.0      76.9
         343.0      22.6
         344.0       6.3
         345.0       2.1
         354.0       1.2
         356.0       1.7
         357.0       1.0
         359.0       1.6
         360.0       5.2
         361.0       1.2
         371.0       1.5
         372.0      18.4
         373.0       5.3
         374.0      10.5
         375.0       2.5
         402.0      45.2
         403.0      12.7
         404.0       2.3
    



in CDCl3



KBr disc



nujol mull





Cortisone acetate(50-04-4) IR2 Atlas of Related Products

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