7-三氟甲基-4-硫醇喹啉

产品名称 7-三氟甲基-4-硫醇喹啉

CAS号64415-07-2

分子式C10H6F3NS

分子量229.22

¹³CNMR

Mass

MS-IW-0567          
7-trifluoromethyl-4-quinolinethiol
C10H6F3NS           (Mass of molecular ion:    229)

   Source Temperature: 180 °C
   Sample Temperature: 110 °C
   Direct, 75 eV

      18.0       1.4
      45.0       1.7
      58.0       3.0
      63.0       1.1
      69.0       3.3
      74.0       1.3
      75.0       2.0
      76.0       1.7
      81.0       1.0
      87.0       1.1
      93.0       1.1
      97.5       1.0
      99.0       1.5
     107.0       1.4
     114.5       3.8
     119.0       1.3
     132.0       1.8
     137.0       2.2
     138.0       1.2
     145.0       6.1
     149.0       1.1
     157.0       5.2
     158.0       1.2
     159.0       2.0
     160.0       1.7
     165.0       2.4
     166.0       1.1
     169.0       7.5
     172.0      22.4
     173.0       2.0
     176.0       2.2
     181.0       1.7
     184.0       1.8
     185.0      13.2
     186.0       1.3
     188.0       1.2
     190.0       1.4
     196.0       5.0
     197.0       1.0
     201.0       6.5
     202.0       1.7
     208.0       3.3
     209.0       7.8
     210.0       4.0
     228.0      10.0
     229.0     100.0
     230.0      13.4
     231.0       5.2

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₀ H₆ F₃ N S	0.036 g : 0.5 ml DMSO-d₆
7-trifluoromethyl-4-quinolinethiol

    Assign.     Shift(ppm)

      A            13.158
      B             8.855
      C             8.05
      D             8.014
      E             7.751
      F             7.427
     
     J(B,E)=8.8HZ
     J(D,F)=6.6HZ

     Hz     ppm     Int.

   5258.79  13.159    168
   3543.46   8.867    437
   3534.67   8.845    456
   3218.99   8.055    643
   3218.26   8.053    626
   3206.30   8.023    498
   3199.71   8.007    521
   3102.78   7.764    347
   3101.32   7.761    363
   3094.24   7.743    340
   3092.77   7.739    354
   3092.29   7.738    353
   2971.44   7.436   1000
   2964.84   7.419    924

in DMSO-d6

KBr disc

nujol mull

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7-三氟甲基-4-硫醇喹啉(64415-07-2)Raman光谱相关产品图谱

7-三氟甲基-4-硫醇喹啉(64415-07-2)质谱(MS) 7-三氟甲基-4-硫醇喹啉(64415-07-2)核磁图(¹HNMR) 7-三氟甲基-4-硫醇喹啉(64415-07-2)红外图谱(IR2) 7-三氟甲基-4-硫醇喹啉(64415-07-2)核磁图(¹³CNMR) 7-三氟甲基-4-硫醇喹啉(64415-07-2)红外图谱(IR1)

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