95-74-9

3-氯对甲苯胺(95-74-9)核磁图(¹³CNMR)

产品名称:3-氯对甲苯胺

CAS:95-74-9

分子式:C7H8ClN

分子量: 141.6

InChI:InChI=1S/C7H8ClN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3

InChIKey: RQKFYFNZSHWXAW-UHFFFAOYSA-N

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

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-5062          
3-chloro-p-toluidine
C7H8ClN             (Mass of molecular ion:    141)

   Source Temperature: 270 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      27.0       2.8
      28.0       4.6
      30.0       1.3
      36.0       2.5
      38.0       1.8
      39.0       3.8
      41.0       1.7
      42.0       1.1
      50.0       4.6
      51.0      10.5
      51.5       2.5
      52.0       7.9
      52.5       8.5
      53.0       3.9
      54.0       2.0
      61.0       1.1
      62.0       1.9
      63.0       3.4
      64.0       1.0
      65.0       1.8
      66.0       1.0
      70.5       2.5
      73.0       1.2
      74.0       1.3
      75.0       1.9
      76.0       2.1
      77.0      21.8
      78.0       8.4
      79.0       6.4
      80.0       1.7
      89.0       1.8
     102.0       1.0
     104.0       9.7
     105.0       5.2
     106.0      65.2
     107.0       6.5
     113.0       2.3
     114.0       1.0
     125.0       1.0
     140.0      82.9
     141.0     100.0
     142.0      33.3
     143.0      32.4
     144.0       2.6

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₈ Cl N	0.04 ml : 0.5 ml CDCl₃
3-chloro-p-toluidine

    Assign.     Shift(ppm)

      A             6.958
      B             6.675
      C             6.473
      D             3.48
      E             2.234

     Hz     ppm     Int.

    627.94   7.012    116
    619.88   6.922    163
    599.31   6.692    181
    596.88   6.665    234
    584.13   6.523    149
    581.75   6.496    116
    576.06   6.433    102
    573.69   6.406     85
    311.81   3.482    317
    202.81   2.265     32
    200.50   2.239    998
    200.19   2.236   1000

in CDCl3