135-67-1

吩噁嗪(135-67-1)红外图谱(IR2)

产品名称:吩噁嗪

CAS:135-67-1

分子式:C12H9NO

分子量: 183.21

InChI:InChI=1S/C12H9NO/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-8,13H

InChIKey: TZMSYXZUNZXBOL-UHFFFAOYSA-N

Smiles:C1=C2C(OC3=C(N2)C=CC=C3)=CC=C1

Mass

MS-NW-6870          
phenoxazine
C12H9NO             (Mass of molecular ion:    183)

   Source Temperature: 150 °C
   Sample Temperature: 110 °C
   Direct, 75 eV

      18.0       1.6
      39.0       1.7
      50.0       2.8
      51.0       3.9
      52.0       2.4
      63.0       3.0
      64.0       1.9
      74.0       1.3
      75.0       1.6
      76.0       1.8
      77.0       4.4
      78.0       1.6
      91.0       1.3
      91.5       8.5
      92.0       1.4
     101.0       1.2
     102.0       1.4
     126.0       1.5
     127.0       5.5
     128.0       4.1
     129.0       1.8
     153.0       2.1
     154.0      22.1
     155.0       5.5
     182.0      17.5
     183.0     100.0
     184.0      13.5
     185.0       1.1

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₂ H₉ N O	0.036 g : 0.5 ml DMSO-d₆
phenoxazine

    Assign.     Shift(ppm)

      A             8.20
      B             6.731
      C             6.608
      D             6.574
      E             6.470

     Hz     ppm     Int.

   3275.39   8.196     63
   2698.97   6.754    321
   2697.27   6.750    344
   2691.89   6.736    490
   2691.28   6.735    476
   2690.06   6.732    534
   2689.58   6.730    493
   2684.20   6.717    448
   2682.37   6.712    484
   2647.58   6.625    308
   2645.87   6.621    433
   2639.65   6.605   1000
   2637.94   6.601    870
   2633.67   6.590    593
   2632.20   6.587    618
   2626.59   6.573    497
   2625.12   6.569    505
   2618.65   6.553    200
   2617.19   6.549    208
   2590.21   6.482    657
   2588.87   6.478    628
   2582.52   6.462    605
   2581.05   6.459    555

DMSO-d6