1HNMR)的核磁圖,紅外圖譜,Raman光譜,質(zhì)譜等圖譜" /> 1HNMR)" />

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返回ChemicalBook首頁(yè)>CAS數(shù)據(jù)庫(kù)列表>25910-85-4更多圖譜> 6-乙氧基-1-甲基-2-(3-硝基苯乙烯基)喹啉硫酸甲酯鹽(25910-85-4)核磁圖(1HNMR)

25910-85-4

6-乙氧基-1-甲基-2-(3-硝基苯乙烯基)喹啉硫酸甲酯鹽(25910-85-4)核磁圖(1HNMR)

分子式:C21H22N2O7S

分子量: 446.47

InChI:InChI=1S/C20H19N2O3.CH4O4S/c1-3-25-19-11-12-20-16(14-19)8-10-17(21(20)2)9-7-15-5-4-6-18(13-15)22(23)24;1-5-6(2,3)4/h4-14H,3H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/b9-7+;

InChIKey: ZXQHSPWBYMLHLB-BXTVWIJMSA-M

Smiles:C12=CC=C(/C=C/C3C=CC=C([N+]([O-])=O)C=3)[N+](C)=C1C=CC(OCC)=C2.S([O-])(=O)(=O)OC

400 MHz in DMSO-d6

  • 圖譜

    1H NMR 399.65 MHz
    C21 H22 N2 O7 S saturated in DMSO-d6
    pinakryptol yellow (methylsulfate)
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.975
      B             8.764
      C             8.525
      D             8.498
      E             8.401
      F             8.304
      G     *1      8.176
      J     *1      8.128
      K             7.83
      L             7.82
      M             7.80
      N             4.602
      P             4.270
      Q             3.391
      R             1.452
  

         Hz     ppm     Int.


       3591.00   8.986     73
   3582.15   8.964     82
   3504.64   8.770     68
   3502.81   8.765    104
   3501.13   8.761     70
   3412.63   8.540     76
   3403.02   8.516     91
   3400.42   8.509    111
   3391.42   8.486     95
   3361.51   8.412     58
   3353.73   8.392     62
   3323.36   8.316     52
   3321.84   8.312     51
   3315.73   8.297     54
   3315.12   8.296     54
   3313.60   8.292     56
   3280.49   8.209     38
   3264.31   8.168    130
   3252.11   8.138    135
   3236.08   8.098     39
   3131.71   7.837    107
   3128.51   7.829     84
   3123.93   7.817    120
   3122.10   7.813     54
   3118.90   7.805    130
   3117.37   7.801    151
   1839.60   4.604    526
   1717.07   4.297     47
   1710.21   4.280    140
   1703.19   4.262    137
   1696.17   4.245     44
   1378.78   3.450     30
   1377.72   3.448     31
   1376.95   3.446     32
   1375.12   3.441     34
   1368.71   3.425     45
   1367.49   3.422     47
   1361.39   3.407     59
   1355.29   3.392   1000
   1349.49   3.377     48
   1342.62   3.360     34
   1339.42   3.352     30
   1338.96   3.351     30
    587.31   1.470    148
    580.44   1.453    306
    573.43   1.435    140

KBr disc

  • 圖譜

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