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MassMS-NW-5437 3-phenylpropyl isobutyrate C13H18O2 (Mass of molecular ion: 206)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
27.0 5.0 39.0 5.0 41.0 8.4 42.0 1.2 43.0 26.4 51.0 3.0 63.0 1.3 65.0 5.3 71.0 6.7 77.0 3.7 78.0 3.0 79.0 1.8 89.0 1.3 91.0 28.5 92.0 3.6 103.0 2.9 104.0 1.4 105.0 3.5 115.0 2.1 116.0 1.6 117.0 59.4 118.0 100.0 119.0 10.9
90 MHz in CDCl3
400 MHz in CDCl3
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1H NMR 89.56 MHz C13 H18 O2 0.04 ml : 0.5 ml CDCl3 3-phenylpropyl isobutyrate 
Assign. Shift(ppm)
A 7.42 to 7.02 B 4.080 C 2.68 D 2.55 E 1.95 F 1.175
Hz ppm Int.651.88 7.279 80 650.88 7.268 43 649.75 7.255 34 647.00 7.225 321 645.06 7.203 289 642.50 7.174 45 641.94 7.168 56 640.50 7.152 31 639.81 7.144 39 639.13 7.137 36 637.38 7.117 31 372.25 4.157 126 365.75 4.084 292 359.25 4.012 150 248.19 2.772 51 241.44 2.696 118 239.00 2.669 60 234.81 2.622 58 233.06 2.603 96 228.00 2.546 65 220.88 2.467 62 214.06 2.391 35 187.94 2.099 30 182.31 2.036 63 181.69 2.029 60 179.94 2.010 52 176.06 1.966 57 173.50 1.938 100 167.00 1.865 64 166.25 1.857 42 108.31 1.210 1000 101.44 1.133 821
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1H NMR 399.65 MHz C13 H18 O2 0.05 ml : 0.5 ml CDCl3 3-phenylpropyl isobutyrate Assign. Shift(ppm)
A 7.269 B 7.18 C 7.17 D 4.078 E 2.678 F 2.541 G 1.947 J 1.171 90MHZ:HSP-03-310
Hz ppm Int.2914.92 7.294 50 2914.18 7.292 66 2912.60 7.288 35 2907.96 7.277 82 2907.35 7.275 94 2906.37 7.273 131 2905.52 7.271 111 2901.98 7.262 45 2900.88 7.259 36 2899.41 7.255 124 2898.80 7.254 132 2897.46 7.250 37 2875.85 7.196 60 2874.76 7.194 70 2869.51 7.181 211 2867.68 7.176 151 2863.53 7.166 67 2861.82 7.161 152 2861.45 7.160 152 1636.23 4.095 163 1629.76 4.078 314 1623.17 4.062 165 1078.00 2.698 100 1070.68 2.680 128 1062.62 2.659 108 1029.79 2.577 35 1022.71 2.560 88 1015.75 2.542 118 1008.79 2.525 90 1001.71 2.507 39 792.11 1.983 47 785.64 1.966 119 784.30 1.963 63 783.20 1.960 44 779.30 1.950 103 777.83 1.947 107 776.61 1.944 113 772.83 1.934 38 771.24 1.930 59 770.14 1.928 118 763.67 1.911 42 471.44 1.180 1000 468.87 1.174 69 464.36 1.162 948 461.91 1.156 71
in CDCl3
liquid film
4880 A,200 M,liquid
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