图谱信息 供应商 相关产品
网站主页CAS数据库列表 349-95-1更多图谱4-(三氟甲基)苄醇(349-95-1)质谱(MS)

4-(三氟甲基)苄醇

产品名称 4-(三氟甲基)苄醇

CAS号349-95-1

分子式C8H7F3O

分子量176.14

展开


  • Mass

    MS-IW-2198          
    4-(trifluoromethyl)benzyl alcohol
    C8H7F3O             (Mass of molecular ion:    176)
    

       Source Temperature: 230 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          27.0       2.0
          28.0       1.1
          29.0       7.5
          31.0       6.2
          38.0       2.0
          39.0       4.8
          50.0       7.7
          51.0      10.6
          52.0       2.1
          53.0       1.3
          57.0       3.0
          61.0       1.0
          62.0       2.8
          63.0       5.6
          64.0       1.0
          69.0       5.9
          74.0       3.5
          75.0       9.5
          76.0       2.6
          77.0      24.8
          78.0       8.3
          79.0      54.1
          80.0       3.8
          81.0       1.6
          83.0       2.1
          87.0       1.3
          88.0       1.3
          89.0       3.7
          90.0       1.4
          95.0       6.6
          96.0       4.4
          99.0       2.3
         101.0       2.0
         105.0       1.6
         107.0     100.0
         108.0       9.2
         109.0       9.8
         114.0       1.3
         119.0       3.7
         125.0       4.9
         126.0       3.8
         127.0      83.9
         128.0       8.8
         129.0       2.2
         138.0       1.7
         139.0       1.3
         140.0       1.5
         145.0      19.9
         146.0       3.8
         147.0      12.6
         148.0       1.4
         155.0       3.2
         156.0       2.3
         157.0      17.9
         158.0       5.3
         159.0      10.4
         160.0       1.2
         173.0       5.2
         174.0       1.0
         175.0      18.1
         176.0      83.7
         177.0       7.4
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C8 H7 F3 O 0.05 ml : 0.5 ml CDCl3
    4-(trifluoromethyl)benzyl alcohol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.535 B 7.343 C 4.604 D 3.68

         Hz     ppm     Int.
    

       3015.75   7.546    840
       3007.69   7.526    971
       2939.70   7.356    827
       2939.09   7.355    927
       2931.15   7.335    773
       2930.42   7.333    727
       1840.21   4.605   1000
       1472.41   3.685    309
    

in CDCl3



liquid film



4880 A,200 M,liquid