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MassMS-NW-8540 o-chloroiodobenzene C6H4ClI (Mass of molecular ion: 238)
Source Temperature: 260 °C Sample Temperature: 140 °C Reservoir, 75 eV
27.0 1.0 36.0 1.1 37.0 3.6 38.0 2.7 39.0 1.5 49.0 4.1 50.0 30.7 51.0 8.4 61.0 2.1 72.0 1.1 73.0 4.3 74.0 17.3 75.0 59.4 76.0 14.1 84.0 3.3 85.0 5.8 86.0 1.3 87.0 1.8 110.0 1.7 111.0 83.3 112.0 6.0 113.0 26.5 114.0 1.8 119.0 2.9 127.0 9.0 238.0 100.0 239.0 6.6 240.0 32.0 241.0 2.1
400 MHz in CDCl3
parameter in TMS
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1H NMR 399.65 MHz C6 H4 Cl I 0.05 ml : 0.5 ml CDCl3 o-chloroiodobenzene 
Assign. Shift(ppm)
A 7.809 B 7.405 C 7.246 D 6.914
Hz ppm Int.3125.98 7.822 805 3124.39 7.818 861 3121.58 7.811 61 3117.92 7.802 860 3116.46 7.798 914 3114.01 7.792 46 2964.60 7.418 741 2963.26 7.415 795 2956.54 7.398 986 2954.96 7.394 1000 2904.30 7.268 700 2902.71 7.264 664 2900.39 7.258 52 2896.97 7.249 782 2896.24 7.247 663 2895.39 7.245 870 2894.78 7.244 667 2891.36 7.235 48 2888.92 7.229 647 2887.33 7.225 630 2771.48 6.935 709 2769.90 6.931 679 2767.58 6.926 53 2764.04 6.917 681 2763.55 6.915 816 2762.57 6.913 778 2761.96 6.911 778 2758.67 6.903 46 2756.10 6.897 570 2754.64 6.893 629
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1H NMR 300 MHz C6 H4 Cl I 10 mol% in TMS o-chloroiodobenzene Parameter ppm Hz
D(A) 7.714 D(B) 6.751 D(C) 7.087 D(D) 7.284 J(A,B) 7.96 J(A,C) 1.55 J(A,D) 0.30 J(B,C) 7.40 J(B,D) 1.53 J(C,D) 8.01 CRECELY,R.W. ET AL. SPECTROCHIM.ACTA 24A, 685 (1968)
Hz ppm Int.2319.00 7.730 848 2317.47 7.725 861 2311.05 7.703 897 2309.53 7.698 908 2190.24 7.301 751 2188.72 7.296 772 2182.25 7.274 990 2180.71 7.269 1000 2134.43 7.115 543 2132.89 7.110 540 2127.02 7.090 735 2126.48 7.088 642 2125.49 7.085 758 2119.05 7.063 485 2117.50 7.058 473 2033.55 6.778 565 2032.00 6.773 558 2025.64 6.752 732 2024.57 6.749 695 2024.12 6.747 687 2018.22 6.727 466 2016.67 6.722 455
in CDCl3
liquid film
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