1775-95-7

2-氨基-5-硝基二苯甲酮(1775-95-7)質(zhì)譜(MS)

產(chǎn)品名稱:2-氨基-5-硝基二苯甲酮

CAS:1775-95-7

分子式:C13H10N2O3

分子量: 242.23

InChI:InChI=1S/C13H10N2O3/c14-12-7-6-10(15(17)18)8-11(12)13(16)9-4-2-1-3-5-9/h1-8H,14H2

InChIKey: PZPZDEIASIKHPY-UHFFFAOYSA-N

Smiles:C(C1=CC([N+]([O-])=O)=CC=C1N)(C1=CC=CC=C1)=O

Mass

MS-IW-1752          
2-amino-5-nitrobenzophenone
C13H10N2O3          (Mass of molecular ion:    242)

   Source Temperature: 140 °C
   Sample Temperature: 100 °C
   Direct, 75 eV

      28.0       1.9
      38.0       1.1
      39.0       2.4
      41.0       2.1
      50.0       2.8
      51.0      11.7
      52.0       7.3
      53.0       1.8
      62.0       2.1
      63.0       5.6
      64.0       4.2
      65.0       2.6
      70.5       1.0
      74.0       1.6
      75.0       1.9
      76.0       2.4
      77.0      56.5
      78.0       4.9
      79.0       1.2
      83.5       3.3
      89.0       1.8
      90.0       2.7
      91.0      13.1
      92.0       1.5
      98.0       2.8
     105.0      57.2
     106.0       5.5
     107.0       1.6
     115.0       2.8
     119.0      18.1
     120.0       1.5
     121.0       1.0
     128.0       1.2
     139.0       4.9
     140.0       3.0
     141.0       4.3
     151.0       3.8
     152.0       2.0
     153.0       1.3
     156.0       1.3
     164.0       1.3
     165.0      29.9
     166.0       7.8
     167.0      15.1
     168.0       4.7
     169.0       1.0
     177.0       1.1
     178.0       1.8
     179.0       3.1
     183.0       3.0
     184.0       1.2
     194.0       3.4
     195.0      34.7
     196.0      10.5
     197.0       1.2
     212.0       1.7
     213.0       2.0
     224.0       2.0
     225.0       6.1
     226.0       2.3
     241.0      89.0
     242.0     100.0
     243.0      14.5
     244.0       1.6

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₃ H₁₀ N₂ O₃	0.039 g : 0.5 ml DMSO-d₆
2-amino-5-nitrobenzophenone

    Assign.     Shift(ppm)

      A             8.24
      B             8.228
      C             8.136
      D             7.68
      E             7.591
      F             6.997

     Hz     ppm     Int.

   3292.36   8.239    417
   3289.67   8.232    839
   3286.99   8.225    814
   3275.51   8.196     30
   3257.69   8.152    351
   3255.00   8.145    303
   3248.41   8.129    365
   3245.73   8.122    333
   3078.61   7.704     67
   3077.27   7.700    149
   3075.81   7.697    122
   3074.58   7.694     87
   3072.63   7.689    390
   3071.29   7.685    561
   3069.95   7.682    780
   3067.99   7.677    207
   3066.53   7.674    251
   3063.72   7.667   1000
   3062.74   7.664    916
   3056.15   7.648     31
   3041.38   7.611    647
   3038.21   7.603    132
   3035.03   7.595    508
   3034.30   7.593    519
   3031.62   7.586    182
   3028.08   7.577    123
   3026.61   7.574    288
   3025.63   7.571    179
   3024.17   7.568     53
   2801.27   7.010    723
   2791.87   6.986    699

DMSO-d6