5039-78-1

甲基丙烯酰氧乙基三甲基氯化铵(5039-78-1)核磁图(¹³CNMR)

产品名称:甲基丙烯酰氧乙基三甲基氯化铵

CAS:5039-78-1

分子式:C9H18ClNO2

分子量: 207.7

InChI:InChI=1S/C9H18NO2.ClH/c1-8(2)9(11)12-7-6-10(3,4)5;/h1,6-7H2,2-5H3;1H/q+1;/p-1

InChIKey: RRHXZLALVWBDKH-UHFFFAOYSA-M

Smiles:C(C[N+](C)(C)C)OC(=O)C(=C)C.[Cl-]

Mass

MS-NW-8242          
(2-(methacryloyloxy)ethyl)trimethylammonium chloride
C9H18ClNO2          (Mass of molecular ion:    207)

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

      15.0       6.9
      18.0       1.0
      27.0       1.2
      28.0       2.1
      29.0       1.3
      30.0       3.8
      36.0       1.2
      39.0       3.1
      40.0       1.2
      41.0       7.0
      42.0       7.5
      43.0       3.6
      44.0       4.0
      45.0       1.4
      49.0       1.6
      50.0      19.9
      52.0       6.4
      56.0       3.5
      57.0       1.9
      58.0     100.0
      59.0       5.2
      69.0       4.8
      70.0       1.9
      71.0      14.2
      72.0       3.3
      86.0       2.3
      97.0       1.8
     113.0       1.3

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₈ Cl N O₂	0.041 g : 0.5 ml CDCl₃
(2-(methacryloyloxy)ethyl)trimethylammonium chloride

    Assign.     Shift(ppm)

      A             6.136
      B             5.671
      C             4.68
      D             4.24
      E             3.590
      F             1.944
     
     J(A,F)=-0.9HZ. J(B,F)=-1.4HZ.

     Hz     ppm     Int.

    550.56   6.148     69
    549.56   6.137     93
    548.50   6.125     65
    509.31   5.687     57
    507.94   5.672     80
    506.50   5.656     58
    423.31   4.727     34
    421.06   4.702     43
    420.31   4.694     45
    419.63   4.686     45
    418.69   4.675     44
    417.38   4.661     45
    416.13   4.647     49
    415.63   4.641     50
    415.25   4.637     50
    384.06   4.289     64
    382.38   4.270     53
    379.25   4.235     52
    377.56   4.216     46
    374.88   4.186     40
    321.63   3.592   1000
    175.25   1.957    197
    174.38   1.948    288
    173.88   1.942    275
    172.94   1.931    187

in CDCl3