576-83-0

2-溴-1,3,5-三甲基苯(576-83-0)红外图谱(IR1)

产品名称:2-溴-1,3,5-三甲基苯

CAS:576-83-0

分子式:C9H11Br

分子量: 199.09

InChI:InChI=1S/C9H11Br/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,1-3H3

InChIKey: RRTLQRYOJOSPEA-UHFFFAOYSA-N

Smiles:C1(C)=CC(C)=CC(C)=C1Br

Mass

MS-NW-8603          
2-bromomesitylene
C9H11Br             (Mass of molecular ion:    198)

   Source Temperature: 250 °C
   Sample Temperature: 140 °C
   Reservoir, 75 eV

      27.0       3.8
      38.0       1.5
      39.0       9.8
      40.0       1.2
      41.0       8.3
      50.0       4.2
      51.0       9.6
      52.0       3.1
      53.0       3.3
      57.0       2.3
      57.5       3.9
      58.0       6.0
      59.0       1.1
      62.0       2.2
      63.0       5.7
      64.0       1.2
      65.0       5.8
      74.0       1.9
      75.0       2.0
      76.0       1.5
      77.0      10.7
      78.0       5.3
      79.0       3.6
      89.0       2.3
      91.0      23.4
      92.0       2.5
      93.0       2.5
      98.0       1.7
      99.0       1.9
     102.0       2.5
     103.0      11.3
     104.0       7.4
     115.0       9.3
     116.0       2.3
     117.0      16.6
     118.0       5.6
     119.0     100.0
     120.0      10.0
     183.0       4.9
     185.0       4.8
     197.0       3.2
     198.0      51.1
     199.0       8.1
     200.0      49.7
     201.0       4.9

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₁ Br	0.04 ml : 0.5 ml CDCl₃
2-bromomesitylene

    Assign.     Shift(ppm)

      A             6.86
      B             2.357
      C             2.218

     Hz     ppm     Int.

    615.19   6.870    200
    614.56   6.862    211
    211.06   2.357   1000
    198.69   2.219    457

in CDCl3

liquid film

4880 A,200 M,liquid

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