2064-80-4

壬二酸二正辛酯(2064-80-4)红外图谱(IR1)

产品名称:壬二酸二正辛酯

CAS:2064-80-4

分子式:C25H48O4

分子量: 412.65

InChI:InChI=1S/C25H48O4/c1-3-5-7-9-14-18-22-28-24(26)20-16-12-11-13-17-21-25(27)29-23-19-15-10-8-6-4-2/h3-23H2,1-2H3

InChIKey: XWVQUJDBOICHGH-UHFFFAOYSA-N

Smiles:C(OCCCCCCCC)(=O)CCCCCCCC(OCCCCCCCC)=O

¹HNMR

¹³CNMR

IR1

Mass

MS2015-05123CW      
dioctyl azelate
C25H48O4            (Mass of molecular ion:    412)

   Source Temperature: 250 °C
   Sample Temperature:  20 °C
   Direct, 70 eV

      18.0       1.8
      27.0       1.8
      28.0       4.4
      29.0       4.1
      39.0       1.7
      41.0      11.9
      42.0       5.4
      43.0      15.6
      44.0       2.2
      54.0       1.7
      55.0      16.7
      56.0       9.3
      57.0      17.5
      60.0       1.1
      61.0       1.5
      67.0       3.2
      68.0       3.2
      69.0      12.9
      70.0       9.2
      71.0      13.2
      73.0       2.5
      79.0       1.0
      81.0       3.2
      82.0       3.8
      83.0      13.5
      84.0       7.5
      85.0       1.2
      87.0       1.9
      95.0       1.5
      96.0       1.3
      97.0       7.5
      98.0       5.9
     101.0       2.3
     107.0       1.7
     110.0       1.9
     111.0       8.6
     112.0       5.5
     113.0       1.0
     115.0       2.1
     116.0       1.2
     123.0       2.1
     124.0       4.4
     125.0      14.9
     126.0       2.0
     129.0      17.7
     130.0       1.6
     135.0       1.3
     138.0       1.0
     139.0       1.5
     143.0       3.9
     144.0       2.5
     145.0       1.5
     151.0       1.6
     152.0      23.2
     153.0       6.9
     154.0       1.3
     155.0       1.3
     157.0       6.2
     170.0       1.3
     171.0     100.0
     172.0      10.7
     173.0       1.4
     185.0       3.9
     199.0       5.0
     227.0       1.0
     240.0       1.1
     241.0      14.5
     242.0       2.6
     254.0       2.4
     255.0       1.3
     256.0       3.0
     269.0       4.3
     282.0       2.3
     283.0      76.4
     284.0      14.4
     285.0       1.9
     297.0       2.5
     301.0       6.3
     302.0       1.2
     311.0       3.4
     412.0       1.4

90 MHz in CDCl3

in CDCl3

¹H NMR	89.56 MHz
C₂₅ H₄₈ O₄	0.04 ml : 0.5 ml CDCl₃
dioctyl azelate

    Assign.     Shift(ppm)

      A             4.048
      B             2.28
      C          1.66 to 1.47
      D          1.33 to 1.24
      E             0.88

     Hz     ppm     Int.

    369.56   4.127    150
    366.44   4.092     31
    363.13   4.055    411
    356.63   3.983    217
    212.63   2.375     78
    211.81   2.366     81
    204.88   2.288    214
    197.38   2.204    163
    158.69   1.772     37
    158.38   1.769     39
    157.38   1.758     39
    151.00   1.687    108
    149.63   1.671    100
    148.75   1.661    101
    144.50   1.614    159
    141.25   1.578    123
    140.63   1.571    121
    140.13   1.565    120
    139.44   1.557    126
    138.94   1.552    128
    138.63   1.548    130
    137.94   1.541    129
    133.50   1.491     94
    133.19   1.488     93
    131.06   1.464    107
    130.31   1.456    110
    130.00   1.452    111
    126.38   1.412    159
    115.81   1.294    983
    114.75   1.282   1000
    105.13   1.174     69
    103.31   1.154     58
    102.56   1.146     56
    102.06   1.140     54
    101.50   1.134     54
    100.81   1.126     52
    100.44   1.122     49
     99.88   1.116     46
     97.75   1.092     31
     97.56   1.090     31
     84.19   0.941    125
     83.00   0.927    113
     82.31   0.920    106
     81.69   0.913    105
     81.06   0.906    105
     79.00   0.883    422
     74.94   0.837     65
     72.94   0.815     87
     71.69   0.801     69
     69.44   0.776     33
     69.06   0.772     30

in CDCl3

liquid film

更多供应商

河北贞佳新材料有限公司