2-Methylphenyl isothiocyanate
Product Name 2-Methylphenyl isothiocyanate
CAS614-69-7
MFC8H7NS
MW149.21
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MassMS-IW-7196 o-tolyl isothiocyanate C8H7NS (Mass of molecular ion: 149)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 1.1 38.0 1.6 39.0 8.5 41.0 1.4 45.0 3.0 50.0 3.1 51.0 5.0 52.0 1.5 61.0 1.3 61.5 1.1 62.0 2.4 63.0 7.6 64.0 3.1 65.0 12.0 70.0 1.0 74.0 1.1 74.5 4.8 75.0 1.8 76.0 1.4 77.0 3.5 78.0 2.6 89.0 12.2 90.0 7.6 91.0 19.5 92.0 1.5 104.0 4.5 105.0 1.7 116.0 10.5 117.0 32.1 118.0 2.9 121.0 13.8 122.0 4.1 123.0 1.2 148.0 31.4 149.0 100.0 150.0 11.1 151.0 4.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C8 H7 N S 0.05 ml : 0.5 ml CDCl3 o-tolyl isothiocyanate 
Assign. Shift(ppm)
A 7.17 to 7.15 B 2.341
Hz ppm Int.2874.39 7.193 33 2872.56 7.188 39 2871.95 7.187 45 2871.09 7.185 62 2870.48 7.183 84 2866.82 7.174 138 2866.21 7.172 130 2865.36 7.170 138 2864.62 7.168 151 2864.01 7.167 148 2862.92 7.164 160 2862.18 7.162 167 2857.91 7.152 385 2855.35 7.145 528 2852.66 7.138 637 2849.98 7.132 85 936.04 2.343 979 935.55 2.341 1000
in CDCl3
liquid film
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