19018-24-7

2-(1-羥乙基)苯并咪唑(19018-24-7)紅外圖譜(IR2)

產(chǎn)品名稱:2-(1-羥乙基)苯并咪唑

CAS:19018-24-7

分子式:C9H10N2O

分子量: 162.19

InChI:InChI=1S/C9H10N2O/c1-6(12)9-10-7-4-2-3-5-8(7)11-9/h2-6,12H,1H3,(H,10,11)

InChIKey: XZHWEHOSQYNGOL-UHFFFAOYSA-N

Smiles:C(C1NC2C=CC=CC=2N=1)(O)C

Mass

MS-IW-1054          
1-(2-benzimidazolyl)ethanol
C9H10N2O            (Mass of molecular ion:    162)

   Source Temperature: 150 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      17.0       1.3
      18.0       6.7
      27.0       1.7
      28.0       2.6
      37.0       1.0
      38.0       2.6
      39.0       6.2
      40.0       1.0
      41.0       2.6
      43.0       5.9
      45.0       4.3
      50.0       1.6
      51.0       3.0
      52.0       4.4
      59.5       5.8
      62.0       2.3
      63.0      11.2
      64.0      13.0
      65.0      16.5
      66.0       2.3
      67.0       1.3
      75.0       1.0
      76.0       1.7
      77.0       2.5
      78.0       1.8
      89.0       1.6
      90.0       9.2
      91.0      24.3
      92.0      26.9
      93.0       2.3
     102.0       1.7
     116.0       2.0
     117.0       5.4
     118.0      44.0
     119.0     100.0
     120.0      13.7
     129.0       1.4
     131.0       2.0
     132.0       3.8
     133.0       2.0
     143.0      36.2
     144.0      40.1
     145.0      28.3
     146.0       4.8
     147.0      68.7
     148.0       6.6
     160.0       2.4
     161.0       8.0
     162.0      97.4
     163.0      12.7
     164.0       1.0

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₉ H₁₀ N₂ O	0.039 g : 0.5 ml DMSO-d₆
1-(2-benzimidazolyl)ethanol

    Assign.     Shift(ppm)

      A            12.3
      B     *1      7.55
      C     *1      7.47
      D             7.14
      E             5.85
      F             4.976
      G             1.533

     Hz     ppm     Int.

   4914.54  12.298     82
   3016.75   7.549     63
   2984.70   7.469     62
   2854.65   7.143    206
   2850.25   7.132    199
   2343.98   5.866    168
   2339.22   5.854    174
   2333.17   5.839     22
   2332.81   5.838     22
   2001.09   5.008     32
   1994.50   4.991     97
   1989.92   4.980    106
   1988.09   4.975    110
   1983.51   4.964    100
   1976.92   4.947     36
    616.17   1.542   1000
    609.58   1.526    999
    602.25   1.507     25

in DMSO-d6