618-62-2

3,5-二氯硝基苯(618-62-2)Raman光谱

产品名称:3,5-二氯硝基苯

CAS:618-62-2

分子式:C6H3Cl2NO2

分子量: 192

InChI:InChI=1S/C6H3Cl2NO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H

InChIKey: RNABGKOKSBUFHW-UHFFFAOYSA-N

Smiles:C1(Cl)=CC([N+]([O-])=O)=CC(Cl)=C1

Mass

MS-NW-1270          
1,3-dichloro-5-nitrobenzene
C6H3Cl2NO2          (Mass of molecular ion:    191)

   Source Temperature: 240 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      28.0       2.3
      30.0      42.9
      36.0       1.7
      37.0       6.6
      38.0       4.0
      47.0       1.0
      49.0       3.3
      50.0      13.6
      51.0       1.8
      60.0       1.8
      61.0       4.1
      62.0       3.4
      63.0       4.5
      72.0       1.7
      73.0      11.6
      74.0      40.5
      75.0      34.1
      76.0       2.5
      83.0       1.6
      84.0       7.5
      85.0       6.6
      86.0       2.8
      87.0       2.5
      97.0       1.8
      98.0       1.0
     107.0       1.1
     108.0       2.2
     109.0      61.0
     110.0      13.4
     111.0      20.3
     112.0       4.1
     119.0       1.1
     126.0       1.2
     133.0      37.0
     134.0       2.1
     135.0      23.8
     136.0       1.4
     137.0       3.8
     144.0       1.0
     145.0     100.0
     146.0       7.4
     147.0      64.5
     148.0       4.3
     149.0      10.4
     161.0       3.4
     163.0       2.2
     175.0       1.3
     191.0      79.2
     192.0       5.6
     193.0      50.1
     194.0       3.6
     195.0       8.0

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₆ H₃ Cl₂ N O₂	0.044 g : 0.5 ml CDCl₃
1,3-dichloro-5-nitrobenzene

    Assign.     Shift(ppm)

      A             8.127
      B             7.694

     Hz     ppm     Int.

    728.81   8.138    903
    726.94   8.117   1000
    690.88   7.715    318
    689.00   7.694    534
    687.13   7.673    275

in CDCl3

KBr disc

nujol mull

4880 A,100M,powder

更多供应商

Capot Chemical Co., Ltd