5344-88-7

苯偶酰腙(5344-88-7)质谱(MS)

产品名称:苯偶酰腙

CAS:5344-88-7

分子式:C14H12N2O

分子量: 224.26

InChI:InChI=1S/C14H12N2O/c15-16-13(11-7-3-1-4-8-11)14(17)12-9-5-2-6-10-12/h1-10H,15H2

InChIKey: CDQPGWNBSOSEMZ-UHFFFAOYSA-N

Smiles:C(=NN)(C1=CC=CC=C1)C(C1=CC=CC=C1)=O

Mass

MS-NW-6240          
benzil monohydrazone
C14H12N2O           (Mass of molecular ion:    224)

   Source Temperature: 160 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      18.0       3.0
      27.0       1.0
      28.0       1.9
      39.0       2.2
      50.0       3.9
      51.0      14.0
      52.0       1.3
      63.0       2.1
      65.0       1.2
      74.0       1.2
      75.0       1.5
      76.0       4.5
      77.0      65.9
      78.0       4.8
      89.0       1.2
      91.0       1.5
      92.0       1.3
     103.0       4.3
     104.0       2.1
     105.0      32.3
     106.0       2.9
     119.0     100.0
     120.0       8.7
     165.0       3.5
     166.0       1.1
     178.0       1.6
     196.0       3.4
     223.0       6.0
     224.0      33.9
     225.0       5.7

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₄ H₁₂ N₂ O	0.039 g : 0.5 ml DMSO-d₆
benzil monohydrazone

    Assign.     Shift(ppm)

      A             8.00
      B             7.772
      C             7.51
      D             7.50
      E             7.44
      F             7.42
      G             7.273

     Hz     ppm     Int.

   3189.70   7.982    292
   3110.96   7.785    603
   3109.59   7.781    788
   3108.06   7.777    384
   3104.86   7.769    253
   3102.72   7.764    999
   3101.20   7.760    754
   3009.03   7.530    239
   3007.97   7.527    405
   3006.59   7.524    214
   3005.37   7.521    216
   3004.00   7.517    165
   3002.47   7.513    294
   3000.79   7.509   1000
   2999.57   7.506    574
   2998.20   7.503    558
   2995.61   7.496    251
   2994.69   7.494    343
   2993.32   7.490    715
   2992.55   7.488    659
   2990.88   7.484    515
   2989.35   7.480    264
   2978.67   7.454    725
   2977.45   7.451    340
   2975.62   7.446    260
   2974.24   7.443    469
   2972.87   7.439    720
   2971.34   7.435    935
   2969.21   7.430    316
   2966.77   7.424    506
   2964.32   7.418    501
   2962.95   7.414    261
   2960.82   7.409    131
   2959.44   7.406    191
   2911.53   7.286    763
   2910.00   7.282    942
   2908.02   7.277    234
   2904.51   7.268    369
   2903.14   7.265    781
   2901.92   7.262    563

in DMSO-d6