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99-33-2

3,5-二硝基苯甲酰氯(99-33-2)质谱(MS)

分子式:C7H3ClN2O5

分子量: 230.56

InChI:InChI=1S/C7H3ClN2O5/c8-7(11)4-1-5(9(12)13)3-6(2-4)10(14)15/h1-3H

InChIKey: NNOHXABAQAGKRZ-UHFFFAOYSA-N

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

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    Mass

    MS-IW-3412          
    3,5-dinitrobenzoyl chloride
    C7H3ClN2O5          (Mass of molecular ion:    230)
    

       Source Temperature: 210 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          28.0       1.0
          30.0       3.3
          35.0       1.7
          36.0      12.0
          37.0       1.6
          38.0       4.0
          50.0       2.5
          51.0       1.1
          61.0       1.2
          62.0       1.8
          63.0       3.8
          73.0       2.5
          74.0      14.2
          75.0      34.7
          76.0       3.9
          78.0       1.2
          91.0       2.2
         101.0       1.2
         103.0       9.8
         104.0       2.9
         106.0       2.0
         110.0       1.3
         119.0       1.9
         120.0       2.0
         137.0       3.6
         138.0       1.0
         139.0       1.2
         148.0       1.2
         149.0      19.4
         150.0      10.1
         179.0       1.2
         195.0     100.0
         196.0       8.7
         197.0       1.3
    

KBr disc

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nujol mull

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