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610-81-1

3-硝基-4-氨基苯酚(610-81-1)紅外圖譜(IR1)

產(chǎn)品名稱(chēng):3-硝基-4-氨基苯酚

CAS:610-81-1

分子式:C6H6N2O3

分子量: 154.12

InChI:InChI=1S/C6H6N2O3/c7-5-2-1-4(9)3-6(5)8(10)11/h1-3,9H,7H2

InChIKey: IQXUIDYRTHQTET-UHFFFAOYSA-N

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

  • 圖譜
    Mass 

    MS-KW-0093          
4-amino-3-nitrophenol
C6H6N2O3            (Mass of molecular ion:    154)


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


          18.0       2.8
      27.0       1.7
      28.0       3.5
      39.0       2.7
      40.0       1.0
      41.0       1.2
      50.0       1.1
      51.0       3.0
      52.0      10.0
      53.0      10.3
      53.5       1.4
      54.0       3.0
      55.0       1.4
      63.0       2.5
      65.0       1.0
      67.0       1.4
      68.0      17.1
      77.0       1.7
      78.0       1.2
      79.0       2.3
      80.0       5.8
      81.0      11.2
      90.0       1.3
      91.0       1.2
      96.0       2.2
     107.0       3.4
     108.0      40.1
     109.0       3.1
     124.0       1.8
     137.0       1.1
     154.0     100.0
     155.0       7.8

400 MHz in DMSO-d6

  • 圖譜

    1H NMR 399.65 MHz
    C6 H6 N2 O3 0.035 g : 0.5 ml DMSO-d6
    4-amino-3-nitrophenol
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             9.31
      B             7.330
      C             7.08
      D             7.047
      E             6.954
  

         Hz     ppm     Int.


       3720.25   9.309   1000
   2931.21   7.335    408
   2928.31   7.328    412
   2829.59   7.081    404
   2823.03   7.064    237
   2820.28   7.057    203
   2814.03   7.042    306
   2811.13   7.034    291
   2782.44   6.963    478
   2773.44   6.940    309

in CDCl3

  • 圖譜

KBr disk

  • 圖譜

Nujol

  • 圖譜

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