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MassMS-NW-8706 m-iodophenol C6H5IO (Mass of molecular ion: 220)
Source Temperature: 270 °C Sample Temperature: 150 °C Reservoir, 75 eV
18.0 1.1 37.0 2.3 38.0 5.8 39.0 20.3 50.0 2.7 51.0 1.1 53.0 4.2 61.0 2.0 62.0 3.9 63.0 9.9 64.0 6.9 65.0 39.6 66.0 3.1 74.0 1.5 92.0 3.7 93.0 52.3 94.0 3.7 110.0 4.4 127.0 3.2 128.0 1.2 191.0 1.2 220.0 100.0 221.0 6.6
parameter in CDCl3
400 MHz in CDCl3
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1H NMR 300 MHz C6 H5 I O 0.044 g : 0.5 ml CDCl3 m-iodophenol 
Parameter ppm Hz
D(A) 7.266 D(B) 7.210 D(C) 6.948 D(D) 6.793 J(A,B) 1.47 J(A,C) 7.96 J(A,D) 1.00 J(B,C) 0.30 J(B,D) 2.50 J(C,D) 8.17 D(E) 5.01
Hz ppm Int.2185.19 7.284 223 2183.87 7.280 345 2182.71 7.276 258 2177.29 7.258 257 2175.96 7.253 411 2174.80 7.249 310 2164.91 7.216 428 2163.43 7.211 421 2162.51 7.208 493 2161.07 7.204 380 2092.62 6.975 330 2084.57 6.949 692 2076.58 6.922 396 2043.37 6.811 300 2042.34 6.808 312 2040.89 6.803 302 2039.86 6.800 288 2035.21 6.784 216 2034.18 6.781 218 2032.75 6.776 216 2031.70 6.772 201 1502.99 5.010 1000
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1H NMR 399.65 MHz C6 H5 I O 0.042 g : 0.5 ml CDCl3 m-iodophenol Assign. Shift(ppm)
A 7.272 B 7.213 C 6.955 D 6.802
Hz ppm Int.2911.87 7.287 415 2911.01 7.284 490 2910.40 7.283 519 2909.42 7.280 478 2904.05 7.267 461 2903.20 7.265 543 2902.59 7.263 603 2901.61 7.261 542 2884.89 7.219 677 2883.30 7.215 692 2882.45 7.213 767 2880.86 7.209 617 2787.96 6.977 582 2779.91 6.956 1000 2771.85 6.936 665 2723.63 6.816 457 2722.78 6.813 503 2721.19 6.809 477 2720.34 6.807 466 2715.45 6.795 373 2714.60 6.793 384 2713.01 6.789 380 2712.04 6.787 353
in CDCl3
KBr disc
nujol mull
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