612-60-2

7-甲基喹啉(612-60-2)質(zhì)譜(MS)

產(chǎn)品名稱:7-甲基喹啉

CAS:612-60-2

分子式:C10H9N

分子量: 143.19

InChI:InChI=1S/C10H9N/c1-8-4-5-9-3-2-6-11-10(9)7-8/h2-7H,1H3

InChIKey: KDYVCOSVYOSHOL-UHFFFAOYSA-N

Smiles:N1C2C(=CC=C(C)C=2)C=CC=1

Mass

MS-NW-0143          
7-methylquinoline
C10H9N              (Mass of molecular ion:    143)

   Source Temperature: 210 °C
   Sample Temperature:  75 °C
   Reservoir, 75 eV

      18.0       1.0
      27.0       1.3
      28.0       1.1
      38.0       1.6
      39.0       6.1
      50.0       3.8
      51.0       5.1
      52.0       1.4
      57.5       2.3
      58.5       5.4
      61.0       1.0
      62.0       3.3
      63.0       7.5
      64.0       2.0
      65.0       2.5
      70.5       3.4
      71.5       4.1
      74.0       2.3
      75.0       2.9
      76.0       1.9
      77.0       1.6
      86.0       1.0
      87.0       1.7
      88.0       1.7
      89.0       7.2
      90.0       2.0
     101.0       1.0
     113.0       1.9
     114.0       2.7
     115.0      16.4
     116.0       6.8
     117.0       5.4
     140.0       2.6
     141.0       7.5
     142.0      45.3
     143.0     100.0
     144.0      11.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₀ H₉ N	31.9 mg : 0.5 ml CDCl₃
7-methylquinoline

    Assign.     Shift(ppm)

      A             8.863
      B             8.081
      C             7.886
      D             7.688
      E             7.363
      F             7.306
      G             2.554

     Hz     ppm     Int.

   3545.04   8.871    146
   3543.33   8.867    156
   3540.77   8.860    157
   3539.06   8.856    159
   3234.86   8.095    101
   3234.25   8.093    110
   3233.28   8.091    115
   3232.54   8.089    110
   3226.68   8.074    110
   3225.95   8.072    119
   3224.98   8.070    122
   3224.37   8.068    116
   3152.10   7.888    218
   3151.25   7.886    222
   3150.51   7.884    176
   3076.90   7.699    216
   3068.60   7.679    246
   2947.63   7.376    151
   2946.04   7.372    155
   2939.33   7.355    137
   2937.62   7.351    149
   2926.15   7.322    181
   2921.88   7.312    181
   2917.97   7.302    174
   2913.70   7.291    170
   1021.48   2.556    984
   1020.87   2.555   1000

in CDCl3