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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>7147-89-9更多圖譜> 4-氯-5-甲基-2-硝基苯酚(7147-89-9)紅外圖譜(IR1)

7147-89-9

4-氯-5-甲基-2-硝基苯酚(7147-89-9)紅外圖譜(IR1)

產(chǎn)品名稱:4-氯-5-甲基-2-硝基苯酚

CAS:7147-89-9

分子式:C7H6ClNO3

分子量: 187.58

InChI:InChI=1S/C7H6ClNO3/c1-4-2-7(10)6(9(11)12)3-5(4)8/h2-3,10H,1H3

InChIKey: JBMGJOKJUYGIJH-UHFFFAOYSA-N

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

  • 圖譜
    Mass 

    MS-IW-0709          
4-chloro-6-nitro-m-cresol
C7H6ClNO3           (Mass of molecular ion:    187)


       Source Temperature: 130 °C
   Sample Temperature: 110 °C
   Direct, 75 eV


          28.0       1.1
      30.0       1.0
      39.0       2.0
      50.0       2.1
      51.0       7.6
      52.0       1.2
      53.0       2.5
      63.0       1.6
      65.0       2.6
      73.0       1.1
      75.0       2.3
      76.0       1.1
      77.0      21.8
      78.0       3.5
      87.0       1.0
      89.0       1.2
      90.0       2.3
      94.0       1.2
      99.0       1.0
     105.0       1.1
     111.0       1.1
     112.0       2.9
     113.0       4.0
     114.0       1.2
     115.0       1.3
     129.0       4.5
     131.0       1.5
     139.0       1.4
     141.0       7.9
     142.0       2.0
     143.0       2.5
     157.0       4.5
     159.0       1.5
     170.0       4.7
     172.0       1.5
     187.0     100.0
     188.0       8.1
     189.0      32.6
     190.0       2.7

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C7 H6 Cl N O3 0.041 g : 0.5 ml CDCl3
    4-chloro-6-nitro-m-cresol
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A            10.43
      B             8.078
      C             7.047
      D             2.417
  

         Hz     ppm     Int.


       4170.33  10.435    622
   3228.49   8.079    414
   2817.10   7.049    281
   2816.73   7.048    291
   2816.37   7.048    278
    966.57   2.419    983
    966.20   2.418   1000
    965.84   2.417    943

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

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