536-90-3

间氨基苯甲醚(536-90-3)核磁图(¹HNMR)

产品名称:间氨基苯甲醚

CAS:536-90-3

分子式:C7H9NO

分子量: 123.15

InChI:InChI=1S/C7H9NO/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H3

InChIKey: NCBZRJODKRCREW-UHFFFAOYSA-N

Smiles:C1(N)=CC=CC(OC)=C1

Mass

MS-NW-3738          
m-anisidine
C7H9NO              (Mass of molecular ion:    123)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       2.4
      17.0       1.0
      18.0       4.7
      27.0       3.8
      28.0       5.9
      37.0       1.4
      38.0       4.0
      39.0      10.2
      40.0       2.5
      41.0       5.4
      42.0       1.4
      50.0       2.3
      51.0       4.0
      52.0       8.9
      53.0      14.5
      54.0       4.0
      61.0       1.1
      61.5       1.7
      62.0       2.0
      63.0       4.4
      64.0       2.8
      65.0      10.1
      66.0      14.2
      67.0       2.8
      68.0       1.5
      77.0       4.0
      78.0       2.6
      79.0       3.7
      80.0      31.4
      81.0       2.3
      91.0       1.2
      92.0       7.0
      93.0      42.6
      94.0      45.8
      95.0       7.9
     104.0       1.0
     105.0       1.3
     106.0       1.6
     107.0       2.1
     122.0       7.0
     123.0     100.0
     124.0       8.3

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₉ N O	0.04 ml : 0.5 ml CDCl₃
m-anisidine

    Assign.     Shift(ppm)

      A             7.03
      B     *1      6.30
      C     *1      6.24
      D             6.21
      E             3.718
      F             3.59

     Hz     ppm     Int.

    638.19   7.126     44
    631.50   7.052     31
    630.13   7.036     73
    629.19   7.026     53
    622.75   6.954     55
    621.75   6.943     65
    570.00   6.365     35
    569.06   6.354     53
    567.75   6.340     47
    566.75   6.329     76
    564.94   6.308     54
    563.94   6.297     44
    562.75   6.284    102
    561.75   6.273     66
    560.31   6.257     60
    558.63   6.238     75
    557.75   6.228     77
    556.06   6.209    249
    554.44   6.191    130
    553.31   6.179     34
    333.00   3.719   1000
    321.25   3.587    233

in CDCl3