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TRIARACHIDIN

Product Name TRIARACHIDIN

CAS620-64-4

MFC63H122O6

MW975.64

¹³CNMR

Mass

MS-IW-5078          
1,2,3-propanetriyl triicosanoate
C63H122O6           (Mass of molecular ion:    974)

   Source Temperature: 190 °C
   Sample Temperature: 250 °C
   Direct, 75 eV

      17.0       1.6
      18.0       9.8
      26.0       6.1
      27.0      12.4
      28.0      25.6
      29.0      17.3
      38.0       1.5
      39.0      12.2
      40.0       3.9
      41.0      52.0
      42.0      15.7
      43.0      73.9
      44.0       4.6
      45.0       1.7
      51.0       1.3
      52.0       1.1
      53.0       4.6
      54.0      10.8
      55.0      83.3
      56.0      27.5
      57.0      88.8
      58.0       6.4
      59.0       2.3
      60.0      26.7
      61.0      10.9
      65.0       1.8
      66.0       2.4
      67.0      21.7
      68.0      14.9
      69.0      53.1
      70.0      23.4
      71.0      60.5
      72.0       4.1
      73.0      36.8
      74.0       3.9
      77.0       2.2
      78.0       2.0
      79.0       7.1
      80.0       5.8
      81.0      24.0
      82.0      18.7
      83.0      54.4
      84.0      34.7
      85.0      40.8
      86.0       3.4
      87.0       9.4
      88.0       1.4
      91.0       3.9
      92.0       2.1
      93.0       5.0
      94.0       4.2
      95.0      21.9
      96.0      15.1
      97.0      47.2
      98.0     100.0
      99.0      18.1
     100.0       7.0
     101.0       6.2
     102.0       2.1
     105.0       1.6
     107.0       3.7
     108.0       2.1
     109.0      13.0
     110.0       6.4
     111.0      29.2
     112.0      26.1
     113.0      13.3
     114.0       1.8
     115.0       7.5
     116.0       6.2
     117.0       2.5
     119.0       1.0
     121.0       4.8
     122.0       1.5
     123.0       7.4
     124.0       3.9
     125.0      11.5
     126.0       4.9
     127.0       5.4
     128.0       1.2
     129.0      22.7
     130.0       3.0
     135.0       3.8
     136.0       1.2
     137.0       4.3
     138.0       2.7
     139.0       5.2
     140.0       2.7
     141.0       3.3
     143.0       3.6
     144.0       1.1
     149.0       2.0
     151.0       1.8
     152.0       1.8
     153.0       2.9
     154.0       2.5
     155.0       3.0
     157.0       3.8
     158.0       5.5
     159.0       1.1
     163.0       1.1
     165.0       1.0
     166.0       1.3
     167.0       1.8
     168.0       1.5
     169.0       2.9
     171.0      11.8
     172.0       2.2
     181.0       1.4
     182.0       1.1
     183.0       2.3
     185.0       7.9
     186.0       1.3
     194.0       1.0
     195.0       1.0
     196.0       1.0
     197.0       1.4
     199.0       2.5
     211.0       1.1
     213.0       6.2
     214.0       1.3
     224.0       1.1
     227.0       6.7
     228.0       1.1
     241.0       2.7
     250.0       1.3
     255.0       2.1
     269.0       7.2
     270.0       1.5
     283.0       2.1
     293.0       1.2
     294.0       2.8
     295.0      20.5
     296.0       4.7
     297.0       1.0
     311.0       1.0
     312.0      14.1
     313.0       3.4
     353.0       2.4
     367.0       1.6
     368.0       1.1
     369.0       9.4
     370.0       2.5
     410.0       3.3
     411.0       2.2
     423.0      14.0
     424.0       4.2
     437.0       1.0
     465.0       1.4
     479.0       2.5
     480.0       1.5
     619.0       1.1
     663.0       4.1

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆₃ H₁₂₂ O₆	0.032 g : 0.5 ml CDCl₃
1,2,3-propanetriyl triicosanoate

    Assign.     Shift(ppm)

      A             5.270
      B     *1      4.294
      C     *1      4.148
      D             2.311
      E             1.609
      F             1.28
      G             1.26
      J             0.879

     Hz     ppm     Int.

    930.42   2.329     31
    925.17   2.315     34
    922.97   2.310     51
    917.72   2.297     22
    915.28   2.291     33
    642.21   1.607     25
    526.61   1.318     34
    514.16   1.287    107
    501.22   1.255   1000
    489.87   1.226     40
    488.89   1.224     40
    358.28   0.897     50
    351.56   0.880    140
    344.60   0.863     58

in CDCl3

KBr disc

nujol mull

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