372-39-4

3,5-二氟苯胺(372-39-4)紅外圖譜(IR1)

產(chǎn)品名稱:3,5-二氟苯胺

CAS:372-39-4

分子式:C6H5F2N

分子量: 129.11

InChI:InChI=1S/C6H5F2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2

InChIKey: KQOIBXZRCYFZSO-UHFFFAOYSA-N

Smiles:C1(N)=CC(F)=CC(F)=C1

Mass

MS-NW-7528          
3,5-difluoroaniline
C6H5F2N             (Mass of molecular ion:    129)

   Source Temperature: 260 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV

      28.0       5.2
      31.0       4.4
      37.0       1.6
      38.0       2.2
      39.0       1.3
      41.0       1.6
      50.0       2.3
      51.0       4.7
      52.0       4.0
      56.0       1.8
      57.0       5.5
      61.0       1.8
      62.0       3.2
      63.0       4.0
      64.0       1.1
      64.5       5.0
      65.0       1.5
      70.0       1.5
      75.0       3.6
      76.0       1.9
      78.0       1.2
      81.0       4.4
      82.0      11.7
      83.0       3.5
      89.0       2.3
      98.0       2.4
      99.0       1.1
     100.0       1.4
     101.0      26.3
     102.0      32.8
     103.0       2.2
     108.0       3.1
     109.0       7.3
     110.0       1.2
     112.0       1.3
     128.0       5.4
     129.0     100.0
     130.0       7.0

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₅ F₂ N	0.039 g : 0.5 ml CDCl₃
3,5-difluoroaniline

    Assign.     Shift(ppm)

      A             6.17
      B             6.15
      C             3.87

     Hz     ppm     Int.

   2480.71   6.208    177
   2478.64   6.203    367
   2476.32   6.197    272
   2470.83   6.183    303
   2469.73   6.180    624
   2467.41   6.174    706
   2463.62   6.165    875
   2462.52   6.162    611
   2461.55   6.160    998
   2460.57   6.157    507
   2459.72   6.155    434
   2457.89   6.151    413
   2456.18   6.146    424
   2454.35   6.142   1000
   2453.37   6.139    459
   2452.15   6.136    428
   2450.07   6.131    151
   2447.88   6.126    103
   2445.92   6.121     54
   2444.70   6.118     68
   1544.80   3.866    203

in CDCl3