ChemicalBook
English   Japanese   Germany   Korea
返回ChemicalBook首页>CAS数据库列表>32692-19-6更多图谱> 5-硝基二氢吲哚(32692-19-6)核磁图(1HNMR)

32692-19-6

5-硝基二氢吲哚(32692-19-6)核磁图(1HNMR)

产品名称:5-硝基二氢吲哚

CAS:32692-19-6

分子式:C8H8N2O2

分子量: 164.16

InChI:InChI=1S/C8H8N2O2/c11-10(12)7-1-2-8-6(5-7)3-4-9-8/h1-2,5,9H,3-4H2

InChIKey: WJQWYAJTPPYORB-UHFFFAOYSA-N

Smiles:N1C2=C(C=C([N+]([O-])=O)C=C2)CC1

  • 图谱
    Mass

    MS-NW-9702          
    5-nitroindoline
    C8H8N2O2            (Mass of molecular ion:    164)
    

       Source Temperature: 120 °C
       Sample Temperature:  90 °C
       Direct, 75 eV
    

          17.0       1.2
          18.0       5.9
          38.0       1.1
          39.0       4.6
          41.0       1.2
          50.0       1.8
          51.0       3.5
          52.0       2.3
          53.0       1.0
          58.5       1.1
          62.0       2.7
          63.0       8.8
          64.0       2.3
          65.0       6.6
          66.0       1.0
          76.0       1.0
          77.0       3.2
          78.0       2.3
          79.0       3.0
          89.0      16.8
          90.0      15.6
          91.0      21.2
          92.0       2.6
         104.0       1.2
         106.0       2.9
         116.0       6.9
         117.0      48.2
         118.0      47.4
         119.0       4.3
         132.0       1.1
         134.0      22.1
         135.0       2.2
         146.0       2.5
         148.0       2.1
         163.0       4.5
         164.0     100.0
         165.0      10.0
    

400 MHz in CDCl3

  • 图谱

    1H NMR 399.65 MHz
    C8 H8 N2 O2 0.035 g : 0.5 ml CDCl3
    5-nitroindoline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.972 B 7.914 C 6.468 D 4.73 E 3.761 F 3.104

         Hz     ppm     Int.
    

       3191.89   7.987    275
       3189.58   7.981    317
       3183.11   7.965    279
       3180.91   7.960    338
       3165.28   7.921    281
       3164.06   7.918    497
       3162.96   7.915    466
       3161.87   7.912    434
       2589.36   6.480    640
       2584.84   6.468     30
       2580.69   6.458    631
       1888.92   4.727    104
       1512.45   3.785    540
       1503.78   3.763   1000
       1495.12   3.742    662
       1248.54   3.125    362
       1240.23   3.104    650
       1231.69   3.082    329
    

in CDCl3

  • 图谱

KBr disc

  • 图谱

nujol mull

  • 图谱

  • 图谱

×