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

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605-69-6

馬休黃(605-69-6)核磁圖(1HNMR)

產品名稱:馬休黃

CAS:605-69-6

分子式:C10H6N2O5

分子量: 234.16

InChI:InChI=1S/C10H6N2O5/c13-10-7-4-2-1-3-6(7)8(11(14)15)5-9(10)12(16)17/h1-5,13H

InChIKey: FFRBMBIXVSCUFS-UHFFFAOYSA-N

Smiles:C1(O)=C2C(C=CC=C2)=C([N+]([O-])=O)C=C1[N+]([O-])=O

  • 圖譜
    Mass

    MS-NW-0348          
    2,4-dinitro-1-naphthol
    C10H6N2O5           (Mass of molecular ion:    234)
    

       Source Temperature: 180 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          17.0       1.3
          18.0       6.5
          27.0       1.3
          28.0       2.8
          30.0       8.6
          38.0       1.4
          39.0       6.6
          41.0       1.7
          43.0       1.8
          44.0       1.4
          50.0       4.9
          51.0       6.3
          52.0       1.4
          53.0       4.8
          55.0       1.6
          57.0       1.4
          61.0       1.9
          62.0       6.2
          63.0      15.9
          64.0       2.8
          65.0       1.4
          69.0       1.1
          74.0       6.0
          75.0      10.0
          76.0       6.8
          77.0       3.3
          78.0       1.1
          85.0       1.3
          86.0       5.9
          87.0       8.1
          88.0      11.0
          89.0       4.6
          90.0       1.7
          98.0       1.8
          99.0       1.2
         100.0       1.9
         101.0      16.4
         102.0      11.2
         103.0       4.1
         104.0       3.1
         105.0       3.2
         110.0       1.2
         111.0       1.1
         112.0       1.4
         113.0      33.2
         114.0      20.0
         115.0       6.4
         116.0       1.5
         117.0       1.1
         118.0       1.2
         127.0       2.5
         128.0       1.2
         129.0      16.7
         130.0       6.6
         131.0       2.0
         132.0       1.2
         141.0      24.8
         142.0      14.4
         143.0       4.1
         144.0       1.2
         145.0       1.2
         146.0       1.2
         157.0      18.5
         158.0       5.7
         159.0       3.9
         160.0       1.0
         171.0       3.0
         172.0       2.3
         187.0      22.8
         188.0       4.8
         189.0       2.5
         202.0       1.2
         204.0       4.7
         206.0       2.5
         217.0      19.2
         218.0       5.2
         234.0     100.0
         235.0      11.9
         236.0       1.7
    

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C10 H6 N2 O5 0.041 g : 0.5 ml CDCl3
    2,4-dinitro-1-naphthol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.914 B *1 8.67 C *1 8.62 D *2 7.93 E *2 7.77

         Hz     ppm     Int.
    

        798.44   8.916   1000
        795.75   8.886     51
        795.44   8.882     51
        782.31   8.736    189
        781.63   8.728    250
        780.38   8.714    283
        778.00   8.687    272
        777.31   8.680    240
        776.44   8.670    207
        775.38   8.658    325
        774.06   8.643    325
        773.00   8.632    264
        772.44   8.625    286
        771.75   8.618    352
        769.75   8.595    350
        769.44   8.592    333
        768.13   8.577    382
        767.44   8.570    280
        719.13   8.030    181
        717.56   8.013    217
        712.13   7.952    427
        710.44   7.933    373
        708.94   7.916    154
        703.94   7.860    399
        702.00   7.839    596
        700.31   7.820    346
        695.00   7.761    135
        693.75   7.747    266
        692.44   7.732    249
        686.69   7.668    115
        685.56   7.655    106
    

in CDCl3

  • 圖譜

CCl4 solution

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

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