60646-30-2

(S)-(+)-2,2,2-TRIFLUORO-1-(9-ANTHRYL)ETHANOL(60646-30-2) ¹³C NMR

Product Name(S)-(+)-2,2,2-TRIFLUORO-1-(9-ANTHRYL)ETHANOL

CAS 60646-30-2

Molecular FormulaC16H11F3O

Molecular Weight276.25

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(S)-(+)-2,2,2-TRIFLUORO-1-(9-ANTHRYL)ETHANOL(60646-30-2) <sup>13</sup>C NMR
Mass

MS-IW-0785          
(S)-(+)-1-(9-anthryl)-2,2,2-trifluoroethanol
C16H11F3O           (Mass of molecular ion:    276)

   Source Temperature: 120 °C
   Sample Temperature: 100 °C
   Direct, 75 eV

      18.0       1.1
      63.0       1.1
      75.0       1.9
      76.0       4.8
      88.0       5.9
      88.5       2.3
      89.0       7.4
      89.5       1.8
     103.5       7.8
     104.0       1.4
     138.0       1.4
     150.0       1.5
     151.0       2.5
     152.0       1.9
     176.0       6.6
     177.0       6.7
     178.0      32.4
     179.0      42.5
     180.0       6.1
     205.0       1.9
     206.0       1.6
     207.0      69.2
     208.0      11.5
     209.0       1.3
     239.0       1.3
     275.0       2.5
     276.0     100.0
     277.0      17.5
     278.0       1.7

400 MHz (at 40.C)

(S)-(+)-2,2,2-TRIFLUORO-1-(9-ANTHRYL)ETHANOL(60646-30-2) <sup>13</sup>C NMR

¹H NMR	399.65 MHz
C₁₆ H₁₁ F₃ O	0.037 g : 0.5 ml CDCl₃ at 40C
(S)-(+)-1-(9-anthryl)-2,2,2-trifluoroethanol

    Assign.     Shift(ppm)

      A     *1      8.9
      B             8.464
      C     *1      8.2
      D             7.972
      E     *2      7.514
      F     *2      7.445
      G             6.574
      J             2.90
     
     J(G,J)=4.4HZ
     J(F-19,G)=8.1HZ

     Hz     ppm     Int.

   3382.87   8.465   1000
   3190.46   7.984    787
   3182.07   7.963    855
   3012.24   7.538    452
   3010.71   7.534    488
   3005.68   7.521    740
   3004.15   7.517    747
   3003.23   7.515    522
   3001.56   7.511    467
   2996.52   7.498    728
   2995.15   7.495    675
   2991.64   7.486     39
   2982.79   7.464    812
   2981.72   7.461    844
   2976.23   7.448    548
   2974.55   7.443    843
   2973.48   7.441    785
   2967.83   7.427    508
   2966.92   7.424    496
   2642.06   6.611     94
   2637.63   6.600    102
   2633.97   6.591    288
   2629.70   6.581    297
   2626.04   6.571    301
   2621.61   6.560    301
   2617.95   6.551    110
   2613.68   6.540    103
   1160.43   2.904    890
   1156.01   2.893    868

in CDCl3