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MassMS-NW-1494 allyl cyanide C4H5N (Mass of molecular ion: 67)
Source Temperature: 250 °C Sample Temperature: 170 °C Reservoir, 75 eV
14.0 1.0 15.0 1.4 18.0 1.3 25.0 1.3 26.0 6.5 27.0 25.9 28.0 5.8 36.0 1.7 37.0 11.2 38.0 14.6 39.0 39.2 40.0 23.2 41.0 100.0 42.0 2.7 50.0 1.4 51.0 2.4 52.0 7.8 62.0 1.3 63.0 2.9 64.0 6.8 65.0 1.9 66.0 12.8 67.0 39.9 68.0 2.1
90 MHz in CDCl3
parameter in CDCl3
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1H NMR 89.56 MHz C4 H5 N 0.04 ml : 0.5 ml CDCl3 allyl cyanide 
Assign. Shift(ppm)
A 5.722 B 5.46 C 5.31 D 3.132
Hz ppm Int.536.44 5.990 62 531.50 5.935 111 526.81 5.883 128 522.06 5.830 136 519.63 5.803 146 517.69 5.781 54 514.88 5.749 274 510.06 5.696 258 507.81 5.671 50 505.44 5.644 489 503.56 5.623 50 501.25 5.597 300 497.63 5.557 182 496.19 5.541 372 495.50 5.533 341 494.63 5.523 707 493.38 5.509 277 483.56 5.400 210 481.94 5.382 438 481.38 5.375 235 480.38 5.364 503 479.56 5.355 312 479.06 5.350 199 477.94 5.337 201 476.63 5.322 64 474.38 5.297 83 472.50 5.276 229 470.94 5.259 294 469.44 5.242 143 283.81 3.169 341 282.88 3.159 1000 281.31 3.142 597 279.56 3.122 557 278.25 3.107 885 276.50 3.088 528
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1H NMR 300 MHz C4 H5 N 35 % in CDCl3 allyl cyanide Parameter ppm Hz
D(A) 5.326 D(B) 5.460 D(C) 5.778 D(D) *1 3.158 D(E) *1 3.158 J(A,B) 1.029 J(A,C) 10.163 J(A,D) -1.215 J(A,E) -1.215 J(B,C) 17.043 J(B,D) -1.892 J(B,E) -1.892 J(C,D) 5.360 J(C,E) 5.360 J(D,E) -19.400 WENDISCH,D. Z.NATURFORSCH. 23B, 616 (1968)
Hz ppm Int.1753.23 5.844 137 1747.92 5.826 272 1743.10 5.810 205 1737.84 5.793 318 1736.22 5.787 206 1732.56 5.775 177 1730.91 5.770 388 1726.06 5.754 291 1720.83 5.736 445 1715.55 5.718 231 1648.16 5.494 244 1646.36 5.488 503 1645.22 5.484 531 1643.39 5.478 261 1631.15 5.437 175 1629.32 5.431 364 1628.18 5.427 360 1626.35 5.421 181 1604.39 5.348 264 1603.22 5.344 640 1602.08 5.340 628 1600.94 5.336 254 1594.34 5.314 224 1593.17 5.311 545 1592.00 5.307 545 1590.86 5.303 223 951.55 3.172 818 950.33 3.168 998 949.77 3.166 1000 948.53 3.162 835 946.27 3.154 833 945.02 3.150 994 944.49 3.148 989 943.24 3.144 798
in CDCl3
liquid film
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