29443-23-0

烯丙基三乙胺溴化物(29443-23-0)紅外圖譜(IR2)

產(chǎn)品名稱(chēng):烯丙基三乙胺溴化物

CAS:29443-23-0

分子式:C9H20BrN

分子量: 222.17

InChI:InChI=1S/C9H20N.BrH/c1-5-9-10(6-2,7-3)8-4;/h5H,1,6-9H2,2-4H3;1H/q+1;/p-1

InChIKey: BDRVEARQBLPFIP-UHFFFAOYSA-M

Smiles:[N+](CC)(CC)(CC)CC=C.[Br-]

Mass

MS-NW-7111          
allyltriethylammonium bromide
C9H20BrN            (Mass of molecular ion:    221)

   Source Temperature: 230 °C
   Sample Temperature: 220 °C
   Direct, 75 eV

      15.0       3.3
      18.0       2.3
      26.0       4.9
      27.0      18.3
      28.0      15.4
      29.0      18.7
      30.0      25.7
      37.0       3.2
      38.0       5.4
      39.0      32.0
      40.0       4.4
      41.0      74.9
      42.0      16.4
      43.0       2.3
      44.0      11.6
      54.0       2.6
      55.0       1.5
      56.0      14.7
      57.0       2.6
      58.0      30.9
      59.0       1.2
      68.0       1.1
      70.0       6.1
      71.0       2.0
      72.0       4.1
      79.0       1.6
      80.0       1.2
      81.0       1.6
      82.0       1.2
      84.0       2.1
      86.0     100.0
      87.0       7.0
      93.0       1.1
      98.0      29.5
      99.0       3.0
     100.0       7.2
     101.0      19.3
     102.0       1.4
     108.0       7.3
     110.0       6.8
     112.0       1.8
     113.0       6.4
     120.0      10.0
     122.0      10.2

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₉ H₂₀ Br N	0.041 g : 0.5 ml CDCl₃
allyltriethylammonium bromide

    Assign.     Shift(ppm)

      A             5.992
      B             5.831
      C             5.720
      D             4.112
      E             3.488
      F             1.428

     Hz     ppm     Int.

   2410.89   6.033     54
   2408.08   6.026     33
   2403.69   6.015     30
   2401.00   6.008     92
   2394.04   5.991    110
   2391.24   5.984     51
   2386.84   5.973     47
   2384.03   5.966    103
   2376.95   5.948     50
   2337.28   5.849    169
   2336.30   5.846    182
   2320.56   5.807    104
   2319.46   5.804    110
   2291.26   5.734    164
   2290.65   5.732    170
   2290.28   5.731    169
   2281.25   5.709    134
   2280.64   5.707    141
   2280.15   5.706    143
   1647.09   4.122    315
   1639.89   4.104    307
   1405.03   3.516    322
   1397.71   3.498    991
   1390.38   3.479   1000
   1383.06   3.461    336
    578.00   1.447    509
    570.80   1.429    947
    563.48   1.410    485

in CDCl3