17039-58-6

化合物 T31200(17039-58-6)红外图谱(IR1)

分子式:C17H22N2O4S2

分子量: 382.5

InChI:InChI=1S/C17H22N2O4S2/c1-19(2)15-8-4-7-13-12(15)6-5-9-16(13)25(22,23)18-14(17(20)21)10-11-24-3/h4-9,14,18H,10-11H2,1-3H3,(H,20,21)/t14-/m0/s1

InChIKey: ADWOYRHKFIZWFB-AWEZNQCLSA-N

Smiles:C(O)(=O)[C@H](CCSC)NS(C1=C2C(C(N(C)C)=CC=C2)=CC=C1)(=O)=O

¹HNMR

IR1

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₇ H₂₂ N₂ O₄ S₂	0.049 g : 0.5 ml CDCl₃
N-(5-dimethylamino-1-naphthylsulfonyl)-L-methione piperidinium salt

    Assign.     Shift(ppm)

      A             8.498
      B             8.376
      C             8.239
      D             7.536
      E             7.483
      F             7.150
      G             3.69
      J             2.857
      K             2.78
      L             2.25
      M             1.85
      N             1.769
      P             1.59
      Q             1.53

     Hz     ppm     Int.

   3400.49   8.509     54
   3392.06   8.488     54
   3352.13   8.388     58
   3343.34   8.366     60
   3297.18   8.251     59
   3295.90   8.247     59
   3289.85   8.232     63
   3288.57   8.229     57
   3019.87   7.557     49
   3012.36   7.538     61
   3011.26   7.535     55
   3003.75   7.516     51
   2998.44   7.503     57
   2991.11   7.485     59
   2990.01   7.482     61
   2982.68   7.464     50
   1482.18   3.709     30
   1477.42   3.697     37
   1476.14   3.694     39
   1142.04   2.858   1000
    707.02   1.770    593
    637.05   1.595     80
    611.04   1.529     44

KBr disc

TargetMol Chemicals Inc.