N-甲基-鄰甲基苯胺(611-21-2)紅外圖譜(IR2)

產(chǎn)品名稱:N-甲基-鄰甲基苯胺

CAS:611-21-2

分子式:C8H11N

分子量: 121.18

InChI:InChI=1S/C8H11N/c1-7-5-3-4-6-8(7)9-2/h3-6,9H,1-2H3

InChIKey: GUAWMXYQZKVRCW-UHFFFAOYSA-N

Smiles:C1(NC)=CC=CC=C1C

Mass

MS-NW-1198          
N-methyl-o-toluidine
C8H11N              (Mass of molecular ion:    121)

   Source Temperature: 240 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       1.2
      18.0       1.4
      27.0       2.9
      28.0       2.1
      30.0       5.0
      38.0       1.8
      39.0       8.5
      41.0       2.3
      42.0       2.5
      50.0       3.3
      51.0       7.5
      52.0       4.5
      53.0       3.5
      54.0       1.1
      58.0       1.8
      58.5       2.0
      59.5       5.0
      60.0       1.0
      60.5       4.0
      62.0       1.9
      63.0       5.0
      64.0       1.7
      65.0      13.1
      66.0       1.7
      76.0       1.1
      77.0      13.1
      78.0       5.1
      79.0       7.7
      80.0       2.0
      89.0       3.5
      90.0       1.8
      91.0      25.5
      92.0       5.4
      93.0       3.5
     104.0       7.0
     105.0       1.7
     106.0      70.3
     107.0       9.4
     117.0       1.5
     118.0       6.5
     119.0       1.7
     120.0      59.0
     121.0     100.0
     122.0       8.8
     134.0       2.0
     135.0       2.4

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₁₁ N	0.04 ml : 0.5 ml CDCl₃
N-methyl-o-toluidine

    Assign.     Shift(ppm)

      A             7.15
      B             7.03
      C             6.64
      D             6.60
      E             3.5
      F             2.862
      G             2.108

     Hz     ppm     Int.

    641.75   7.166     86
    641.31   7.161     57
    640.75   7.155     47
    639.81   7.144     66
    639.31   7.139     61
    634.56   7.086     66
    633.69   7.076     76
    633.13   7.070     72
    632.38   7.061     83
    631.75   7.054     65
    628.31   7.016     55
    627.56   7.008     82
    626.81   6.999     75
    626.25   6.993     60
    625.69   6.987     55
    603.25   6.736     48
    602.13   6.724     69
    594.75   6.641    176
    587.13   6.556     76
    256.31   2.862   1000
    188.75   2.108    584

in CDCl3