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MS-KW-0517 3-phenoxy-1,2-propanediol C9H12O3 (Mass of molecular ion: 168)
Source Temperature: 140 °C Sample Temperature: 120 °C Direct, 75 eV
19.0 1.5 27.0 1.6 29.0 3.0 31.0 3.8 39.0 3.9 43.0 4.2 45.0 1.6 50.0 1.1 51.0 4.9 55.0 1.0 57.0 3.2 61.0 3.1 63.0 1.0 65.0 5.1 66.0 4.3 74.0 1.2 75.0 1.0 77.0 15.3 78.0 5.3 79.0 3.3 91.0 2.5 93.0 1.8 94.0 100.0 95.0 13.3 107.0 5.5 108.0 6.5 119.0 4.3 137.0 2.4 168.0 27.1 169.0 2.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C9H12O3 0.041 g : 0.5 ml CDCl3 3-phenoxy-1,2-propanediol Assign. Shift(ppm)
A 7.239 B 6.939 C 6.865 D 4.074 E 3.955 F 3.83 G *1 3.777 J *1 3.692 K 3.49
Hz ppm Int.
2904.79 7.266 66 2902.35 7.260 380 2901.49 7.258 184 2900.27 7.255 150 2897.47 7.248 97 2895.02 7.242 533 2893.56 7.238 566 2891.24 7.233 94 2888.31 7.225 174 2887.09 7.222 216 2886.24 7.220 471 2883.79 7.214 67 2781.74 6.959 130 2780.64 6.956 229 2779.67 6.953 153 2773.32 6.938 378 2772.47 6.935 210 2766.97 6.922 107 2766.00 6.919 183 2764.90 6.916 112 2749.52 6.878 504 2748.42 6.875 604 2746.34 6.870 176 2742.68 6.861 191 2741.70 6.858 294 2740.73 6.856 524 2739.63 6.853 441 2737.07 6.847 62 1631.23 4.081 98 1625.98 4.068 111 1583.38 3.961 1000 1577.89 3.947 712 1533.09 3.835 160 1529.18 3.826 150 1517.09 3.795 75 1505.25 3.766 128 1482.06 3.708 99 1476.32 3.693 90 1470.59 3.679 55 1464.24 3.663 34 1395.39 3.491 128
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