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MS-NW-8658 3-pyridinol C5H5NO (Mass of molecular ion: 95)
Source Temperature: 260 °C Sample Temperature: 140 °C Reservoir, 75 eV
18.0 1.3 26.0 1.5 27.0 2.0 28.0 7.3 29.0 1.8 37.0 4.2 38.0 8.2 39.0 25.3 40.0 15.1 41.0 13.2 42.0 5.8 49.0 1.0 50.0 2.8 51.0 3.0 52.0 1.6 53.0 1.6 55.0 5.3 66.0 5.8 67.0 12.7 68.0 12.9 69.0 1.2 94.0 3.7 95.0 100.0 96.0 6.1
400 MHz in CDCl3
parameter in DMSO-d6
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1H NMR 399.65 MHz C5 H5 N O saturated in CDCl3 3-pyridinol Assign. Shift(ppm)
A 8.284 B 8.093 C 7.327 D 7.29 THE OH-PEAK IS NOT OBSERVED.
Hz ppm Int.
3315.31 8.296 102 3312.13 8.288 905 3310.18 8.283 964 3309.81 8.282 1000 3306.64 8.274 189 3305.91 8.273 143 3304.32 8.269 108 3303.96 8.268 85 3239.99 8.108 119 3236.21 8.098 743 3233.03 8.090 775 3231.93 8.087 779 3229.61 8.082 202 3228.76 8.079 161 3228.27 8.078 141 3227.54 8.076 103 3226.93 8.075 96 3226.56 8.074 94 3226.20 8.073 91 2937.62 7.351 87 2936.28 7.348 273 2934.81 7.344 351 2933.84 7.342 311 2933.47 7.341 309 2932.01 7.337 324 2930.54 7.333 138 2927.86 7.327 679 2926.51 7.323 766 2925.29 7.320 838 2923.71 7.316 724 2921.75 7.311 199 2920.53 7.308 161 2919.68 7.306 160 2917.24 7.300 913 2914.92 7.294 231 2912.60 7.288 892 2909.06 7.280 432 2906.98 7.274 165 2906.62 7.273 162 2900.63 7.258 146 2899.90 7.257 140 2899.41 7.255 110 2899.05 7.254 93
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1H NMR 300 MHz C5 H5 N O 1 M in DMSO-d6 3-pyridinol Parameter ppm Hz
D(A) 8.363 D(B) 7.315 D(C) 7.258 D(D) 8.146 J(A,B) 2.80 J(A,C) 0.70 J(A,D) -0.15 J(B,C) 8.35 J(B,D) 1.45 J(C,D) 4.65 D(E) 9.905 VOEGELI,U. & VON PHILIPSBORN,W. ORG.MAGN.RESON. 5, 551 (1973)
Hz ppm Int.
2971.50 9.905 1000 2510.56 8.369 332 2509.95 8.366 337 2507.90 8.360 348 2507.29 8.358 339 2446.88 8.156 265 2445.26 8.151 275 2442.41 8.141 277 2440.79 8.136 277 2201.79 7.339 82 2200.19 7.334 100 2199.17 7.331 88 2197.50 7.325 86 2193.43 7.311 212 2191.81 7.306 233 2190.82 7.303 244 2189.14 7.297 204 2183.15 7.277 248 2182.49 7.275 252 2178.66 7.262 235 2178.05 7.260 237 2174.82 7.249 100 2174.16 7.247 94 2170.33 7.234 101 2169.69 7.232 97
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