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115-27-5

氯桥酸酐(115-27-5)核磁图(13CNMR)

产品名称:氯桥酸酐

CAS:115-27-5

分子式:C9H2Cl6O3

分子量: 370.83

InChI:InChI=1S/C9H2Cl6O3/c10-3-4(11)8(13)2-1(5(16)18-6(2)17)7(3,12)9(8,14)15/h1-2H

InChIKey: FLBJFXNAEMSXGL-UHFFFAOYSA-N

Smiles:C1(=O)C2C(C3(Cl)C(Cl)(Cl)C2(Cl)C(Cl)=C3Cl)C(=O)O1

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    Mass

    MS2017-05387CM      
    1,4,5,6,7,7-hexachloro-5-norbornene-2,3-dicarboxylic anhydride
    C9H2Cl6O3           (Mass of molecular ion:    368)
    

       Source Temperature: 245 °C
       Sample Temperature:  20 °C
       Direct, 70 eV
    

          18.0       2.3
          26.0       7.6
          27.0       2.0
          28.0       2.6
          29.0       2.6
          35.0       1.1
          36.0       2.3
          37.0       2.2
          39.0       1.3
          41.0       3.8
          42.0       1.9
          43.0       7.7
          44.0       1.8
          47.0       2.2
          49.0       1.8
          50.0       1.7
          53.0       1.3
          54.0       1.6
          56.0       2.2
          57.0       3.1
          60.0       5.8
          61.0       4.0
          62.0       1.5
          63.0       4.7
          65.0       1.9
          70.0       1.5
          71.0       2.6
          72.0       2.3
          73.0       3.8
          74.0       2.2
          77.0       1.6
          78.0       2.3
          79.0       1.0
          82.0       1.1
          83.0       2.7
          84.0       4.1
          85.0       5.1
          86.0       3.9
          89.0       3.4
          91.0       1.4
          92.0       1.0
          94.0       1.2
          95.0       8.9
          96.0       7.3
          97.0       4.5
          98.0       1.2
         106.0       2.1
         107.0       6.9
         108.0       3.3
         109.0       5.0
         110.0       1.1
         111.0       1.0
         112.5       2.2
         113.0       3.2
         114.0       3.5
         115.0       1.6
         117.0       3.3
         118.0       1.6
         119.0       3.4
         120.0       4.1
         121.0       5.1
         122.0       1.6
         123.0       1.6
         127.0       1.3
         128.0       1.6
         130.5       5.6
         131.5       8.7
         132.5       5.6
         133.0       2.7
         141.0       6.1
         143.0       7.0
         144.0       1.2
         145.0       2.9
         155.0       2.7
         156.0       1.3
         157.0       1.8
         165.0       4.5
         167.0       5.7
         169.0       2.7
         179.0       1.8
         181.0       1.6
         191.0      16.2
         192.0       1.5
         193.0      15.7
         194.0       1.3
         195.0       5.0
         201.0       1.7
         203.0       2.2
         205.0       1.1
         207.0      13.9
         208.0       1.1
         209.0      13.3
         210.0       1.0
         211.0       4.3
         214.0       2.6
         216.0       3.4
         218.0       1.8
         225.0       2.0
         226.0       3.9
         227.0       3.0
         228.0       5.1
         229.0       1.8
         230.0       2.5
         235.0      13.2
         237.0      21.2
         238.0       1.2
         239.0      13.5
         241.0       4.6
         243.0       1.1
         254.0       4.1
         256.0       5.1
         258.0       2.5
         261.0      61.6
         262.0       4.8
         263.0     100.0
         264.0       7.4
         265.0      63.4
         266.0       4.8
         267.0      20.1
         268.0       1.6
         269.0       3.7
         270.0       9.4
         271.0       1.3
         272.0      17.9
         273.0       1.2
         274.0      14.2
         276.0       6.2
         277.0       4.2
         278.0       1.7
         279.0       6.2
         281.0       4.0
         283.0       1.3
         289.0       2.8
         291.0       4.5
         293.0       2.9
         295.0       1.0
         298.0       1.1
         305.0       6.5
         307.0      10.5
         309.0       6.7
         311.0       2.2
         333.0       8.7
         335.0      14.0
         336.0       1.4
         337.0       9.0
         339.0       3.0
         368.0       5.8
         370.0      11.2
         371.0       1.1
         372.0       8.9
         374.0       3.9
    

parameter in CDCl3

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    1H NMR 300 MHz
    C9 H2 Cl6 O3 0.043 g : 0.5 ml CDCl3
    1,4,5,6,7,7-hexachloro-5-norbornene-2,3-dicarboxylic anhydride
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 4.154

         Hz     ppm     Int.
    

       1246.20   4.154   1000
    

in DMSO-d6

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CCl4 solution

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KBr disk

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Nujol

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