3-Methylphenyl isothiocyanate
Product Name 3-Methylphenyl isothiocyanate
CAS621-30-7
MFC8H7NS
MW149.21
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MS-IW-7197 m-tolyl isothiocyanate C8H7NS (Mass of molecular ion: 149)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 1.0 38.0 1.6 39.0 8.7 41.0 1.8 45.0 1.8 50.0 3.0 51.0 4.5 52.0 1.3 61.0 1.3 61.5 1.3 62.0 2.4 63.0 6.9 64.0 2.7 65.0 16.4 66.0 1.1 70.0 1.0 74.0 1.2 74.5 4.3 75.0 1.7 76.0 1.2 77.0 2.3 78.0 1.4 89.0 7.1 90.0 4.6 91.0 50.1 92.0 3.9 104.0 2.6 116.0 4.3 117.0 7.2 121.0 4.6 122.0 1.5 148.0 19.3 149.0 100.0 150.0 10.6 151.0 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 m-tolyl isothiocyanate Assign. Shift(ppm)
A 7.200 B 7.063 C 7.01 D 6.99 E 2.316
Hz ppm Int.
2885.86 7.221 97 2878.30 7.203 225 2870.48 7.183 144 2826.90 7.074 155 2819.21 7.055 121 2818.48 7.053 109 2800.05 7.007 295 2799.32 7.005 334 2798.58 7.003 320 2791.02 6.984 114 2790.41 6.983 114 2789.92 6.981 109 925.66 2.317 1000
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