10,11-二氫卡馬西平(3564-73-6)Raman光譜

產(chǎn)品名稱:10,11-二氫卡馬西平

CAS:3564-73-6

分子式:C15H14N2O

分子量: 238.28

InChI:InChI=1S/C15H14N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-8H,9-10H2,(H2,16,18)

InChIKey: PHNLCHMJDSSPDQ-UHFFFAOYSA-N

Smiles:N1(C(N)=O)C2=CC=CC=C2CCC2=CC=CC=C12

¹HNMR

IR1

Raman

400 MHz in CDCl3

90 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₅ H₁₄ N₂ O	0.029 g : 0.5 ml CDCl₃
10,11-dihydro-5H-dibenz(b,f)azepine-5-carboxamide

    Assign.     Shift(ppm)

      A             7.387
      B             7.20
      C             7.19
      D             5.09
      E     *1      3.41
      F     *1      2.82

     Hz     ppm     Int.

   2959.84   7.407     47
   2957.28   7.400    142
   2954.35   7.393    164
   2953.25   7.390    130
   2951.29   7.385    133
   2949.46   7.381    147
   2947.63   7.376    171
   2945.43   7.371     57
   2890.87   7.234     25
   2888.67   7.229     41
   2883.67   7.216    135
   2878.66   7.203    458
   2876.95   7.199    664
   2874.27   7.192   1000
   2865.23   7.170     23
   2035.89   5.095     40
   1361.69   3.408     46
   1125.00   2.815     46

¹H NMR	89.56 MHz
C₁₅ H₁₄ N₂ O	0.021 g : 0.5 ml CDCl₃
10,11-dihydro-5H-dibenz(b,f)azepine-5-carboxamide

    Assign.     Shift(ppm)

      A             7.37
      B          7.25 to 7.11
      C             4.99
      D     *1      3.29
      E     *1      2.89
     
     400MHZ. : HSP-41-757

     Hz     ppm     Int.

    669.44   7.475     27
    667.31   7.451     73
    663.44   7.408    115
    661.00   7.381    148
    659.81   7.368    162
    657.44   7.341    222
    655.19   7.316    135
    651.25   7.272    117
    648.94   7.246    232
    645.31   7.206   1000
    642.38   7.173    715
    636.50   7.107     88
    633.69   7.076     38
    633.25   7.071     36
    447.38   4.996    114
    295.13   3.296     57
    259.44   2.897     60

KBr disc