2-AMINO-4-PHENYLPHENOL(1134-36-7) MS

Product Name2-AMINO-4-PHENYLPHENOL

CAS 1134-36-7

Molecular FormulaC12H11NO

Molecular Weight185.22

InChIInChI=1S/C12H11NO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H,13H2

InChIKey IGIDZGNPFWGICD-UHFFFAOYSA-N

SmilesC1(C2=CC=CC=C2)=CC=C(O)C(N)=C1

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Mass

MS-NW-3759          
3-aminobiphenyl-4-ol
C12H11NO            (Mass of molecular ion:    185)

   Source Temperature: 180 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      28.0       1.0
      39.0       1.1
      51.0       2.0
      52.0       1.0
      63.0       1.5
      65.0       1.4
      77.0       2.3
      78.0       1.5
      80.0       1.2
      92.5       3.6
     102.0       1.0
     115.0       2.2
     127.0       1.7
     128.0       3.0
     129.0       2.0
     130.0       1.7
     139.0       6.7
     140.0       3.4
     141.0       1.0
     154.0       1.4
     156.0      12.2
     157.0       1.9
     184.0       5.9
     185.0     100.0
     186.0      13.7
     187.0       1.1

90 MHz in DMSO-d6

¹H NMR	89.56 MHz
C₁₂ H₁₁ N O	0.042 g : 0.5 ml DMSO-d₆
3-aminobiphenyl-4-ol

    Assign.     Shift(ppm)

      A             9.
      B             7.49
      C             7.37
      D             7.26
      E             6.94
      F             6.75
      G             6.73
      J             4.6

     Hz     ppm     Int.

    678.06   7.572    111
    675.88   7.547    158
    673.63   7.522     94
    671.50   7.498    227
    669.38   7.475    406
    667.94   7.459    570
    666.06   7.438    289
    663.69   7.411    106
    660.06   7.371    431
    658.13   7.349    135
    656.50   7.331     70
    653.81   7.301    257
    651.88   7.279    328
    649.75   7.255    149
    646.31   7.217     93
    645.50   7.208    142
    641.13   7.159     31
    640.44   7.151     31
    639.19   7.138     34
    622.63   6.953    257
    621.56   6.941    384
    620.19   6.925    275
    611.38   6.827     30
    604.19   6.747   1000
    603.25   6.736    653
    414.31   4.627     44

in DMSO-d6