2,5-二甲基苯胺(95-78-3)核磁圖(¹HNMR)

產(chǎn)品名稱:2,5-二甲基苯胺

CAS:95-78-3

分子式:C8H11N

分子量: 121.18

InChI:InChI=1S/C8H11N/c1-6-3-4-7(2)8(9)5-6/h3-5H,9H2,1-2H3

InChIKey: VOWZNBNDMFLQGM-UHFFFAOYSA-N

Smiles:C1(N)=CC(C)=CC=C1C

Mass

MS-NW-0567          
2,5-xylidine
C8H11N              (Mass of molecular ion:    121)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       1.2
      27.0       2.8
      28.0       3.3
      30.0       1.4
      38.0       1.3
      39.0       5.6
      41.0       2.6
      42.0       3.4
      50.0       1.9
      51.0       4.6
      52.0       2.9
      53.0       4.5
      54.0       1.6
      58.5       1.7
      59.5       1.7
      60.5       1.7
      63.0       1.8
      65.0       3.8
      66.0       1.5
      77.0      12.1
      78.0       5.8
      79.0       4.8
      80.0       2.3
      91.0       8.0
      92.0       2.0
      93.0       4.4
      94.0       1.5
     103.0       4.9
     104.0       5.3
     105.0       2.3
     106.0      53.3
     107.0       5.0
     118.0       2.3
     119.0       1.7
     120.0      54.0
     121.0     100.0
     122.0       9.4

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₁₁ N	0.04 ml : 0.5 ml CDCl₃
2,5-xylidine

    Assign.     Shift(ppm)

      A             6.900
      B             6.49
      C             6.47
      D             3.43
      E             2.225
      F             2.101

     Hz     ppm     Int.

    622.81   6.955    104
    615.19   6.870    156
    614.88   6.866    159
    585.75   6.541    142
    579.13   6.467    403
    578.81   6.463    393
    307.19   3.430    275
    199.69   2.230    951
    199.31   2.226    972
    188.13   2.101   1000

in CDCl3