2696-84-6

对丙基苯胺(2696-84-6)核磁图(¹³CNMR)

产品名称:对丙基苯胺

CAS:2696-84-6

分子式:C9H13N

分子量: 135.21

InChI:InChI=1S/C9H13N/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,2-3,10H2,1H3

InChIKey: OAPDPORYXWQVJE-UHFFFAOYSA-N

Smiles:C1(N)=CC=C(CCC)C=C1

¹HNMR

¹³CNMR

IR1

Mass

MS-IW-1274          
p-propylaniline
C9H13N              (Mass of molecular ion:    135)

   Source Temperature: 240 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      39.0       1.5
      51.0       1.4
      52.0       1.2
      53.0       1.1
      65.0       2.2
      77.0       6.0
      78.0       2.4
      79.0       4.0
      91.0       1.4
      92.0       1.4
      93.0       1.3
     104.0       1.2
     106.0     100.0
     107.0       8.7
     118.0       1.1
     119.0       1.2
     135.0      26.7
     136.0       2.8

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₉ H₁₃ N	0.05 ml : 0.5 ml CDCl₃
p-propylaniline

    Assign.     Shift(ppm)

      A             6.936
      B             6.563
      C             3.41
      D             2.453
      E             1.562
      F             0.902

     Hz     ppm     Int.

   2779.30   6.955     49
   2776.73   6.948    389
   2774.66   6.943    142
   2770.39   6.933    149
   2768.19   6.927    470
   2766.24   6.922     57
   2765.63   6.921     67
   2628.66   6.578     67
   2626.10   6.572    506
   2623.90   6.566    182
   2619.63   6.555    166
   2617.55   6.550    512
   2614.99   6.544     64
   1363.77   3.413     42
    988.53   2.474    229
    980.96   2.455    299
    973.14   2.435    264
    644.04   1.612     50
    636.60   1.593    183
    629.03   1.574    273
    622.80   1.559    122
    621.58   1.556    301
    615.60   1.541     53
    614.01   1.537    199
    606.81   1.519     57
    367.92   0.921    543
    360.60   0.903   1000
    353.27   0.884    532

in CDCl3