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1655-52-3

二硝基苯丙氨酸(1655-52-3)红外图谱(IR1)

产品名称:二硝基苯丙氨酸

CAS:1655-52-3

分子式:C9H9N3O6

分子量: 255.18

InChI:InChI=1S/C9H9N3O6/c1-5(9(13)14)10-7-3-2-6(11(15)16)4-8(7)12(17)18/h2-5,10H,1H3,(H,13,14)/t5-/m0/s1

InChIKey: KKHLKORVTUUSBC-YFKPBYRVSA-N

Smiles:C(O)(=O)[C@H](C)NC1=CC=C([N+]([O-])=O)C=C1[N+]([O-])=O

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    Mass

    MS-NW-2030          
    N-(2,4-dinitrophenyl)-L-alanine
    C9H9N3O6            (Mass of molecular ion:    255)
    

       Source Temperature: 190 °C
       Sample Temperature: 230 °C
       Direct, 75 eV
    

          12.0       1.6
          14.0       1.0
          15.0       4.7
          16.0       4.8
          17.0      13.6
          18.0      68.2
          22.0       1.0
          26.0       3.4
          27.0       8.5
          28.0      16.8
          29.0       5.3
          30.0      12.9
          37.0       3.2
          38.0       8.0
          39.0      10.7
          40.0       3.8
          41.0       4.6
          42.0      15.3
          43.0      70.6
          44.0     100.0
          45.0       3.1
          46.0       1.7
          50.0       7.9
          51.0      11.6
          52.0      14.6
          53.0       3.9
          54.0       1.5
          55.0       1.1
          61.0       3.6
          62.0      12.2
          63.0      36.3
          64.0      12.2
          65.0       6.6
          66.0       6.2
          67.0       2.0
          74.0       5.8
          75.0      13.3
          76.0      11.5
          77.0      12.3
          78.0      14.4
          79.0       5.7
          80.0       4.2
          87.0       1.4
          88.0       3.2
          89.0       9.9
          90.0      34.0
          91.0      13.0
          92.0       4.6
          93.0       4.0
          94.0       2.0
         102.0       3.6
         103.0       6.5
         104.0      18.8
         105.0       7.9
         106.0       7.2
         107.0       4.0
         116.0       7.3
         117.0       9.7
         118.0      14.4
         119.0      15.0
         120.0       2.9
         121.0       2.8
         129.0       4.3
         130.0       6.4
         131.0      48.4
         132.0       7.2
         133.0       5.0
         134.0       5.6
         135.0       2.2
         137.0       5.5
         145.0       1.5
         146.0       3.3
         147.0      26.8
         148.0       4.7
         149.0       3.0
         151.0       1.8
         153.0       4.2
         161.0       8.2
         162.0       1.8
         163.0       6.1
         164.0      12.6
         165.0       2.3
         166.0       1.3
         167.0       9.5
         168.0       1.0
         175.0       5.0
         176.0       2.2
         177.0      85.7
         178.0       9.8
         179.0       3.6
         191.0       3.0
         192.0       1.9
         193.0      25.1
         194.0       4.7
         195.0       1.1
         205.0       1.0
         209.0       4.7
         210.0      29.1
         211.0       3.0
         255.0       3.3
    

KBr disc

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nujol mull

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