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MassMS-NW-4781 thioisonicotinamide C6H6N2S (Mass of molecular ion: 138)
Source Temperature: 170 °C Sample Temperature: 110 °C Direct, 75 eV
18.0 3.3 26.0 2.5 28.0 4.8 32.0 1.3 33.0 1.0 34.0 1.9 37.0 1.4 38.0 1.7 39.0 3.9 45.0 2.2 49.0 1.5 50.0 8.7 51.0 20.3 52.0 13.9 53.0 2.7 59.0 1.0 60.0 26.6 62.0 1.5 64.0 2.1 66.0 1.1 67.0 1.3 69.0 3.2 75.0 1.6 76.0 3.8 77.0 7.9 78.0 18.2 79.0 19.6 80.0 1.3 83.0 1.1 84.0 1.2 93.0 1.2 95.0 1.0 103.0 1.4 104.0 14.5 105.0 28.1 106.0 2.6 110.0 2.8 111.0 2.7 122.0 10.9 137.0 4.8 138.0 100.0 139.0 8.6 140.0 5.0
parameter in DMSO-d6
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1H NMR 300 MHz C6 H6 N2 S 30 % in DMSO thioisonicotinamide 
Parameter ppm Hz
D(A) 8.94 D(B) 8.06 J(A,A') 0.4 J(A,B) 5.0 J(A,B') 0.8 J(A',B) 0.8 J(A',B') 5.0 J(B,B') 1.5 D(C) 10.4 BRUEGEL,W. Z.ELEKTROCHEM.(BER.BUNSENGES.PHYS.CHEM.) 66, 159 (1962) H(C):BROAD.
Hz ppm Int.3120.01 10.400 1000 2684.91 8.950 332 2683.57 8.945 202 2680.50 8.935 203 2679.16 8.931 348 2420.86 8.070 347 2419.51 8.065 203 2416.45 8.055 202 2415.11 8.050 332
KBr disc
liquid film
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