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MassMS-NW-7413 1-nitrohexane C6H13NO2 (Mass of molecular ion: 131)
Source Temperature: 210 °C Sample Temperature: 190 °C Reservoir, 75 eV
26.0 1.2 27.0 14.9 28.0 3.7 29.0 18.6 30.0 3.6 31.0 2.8 39.0 11.7 40.0 2.3 41.0 47.7 42.0 9.9 43.0 100.0 44.0 3.7 45.0 5.8 46.0 2.2 51.0 1.0 53.0 2.7 54.0 1.8 55.0 52.2 56.0 12.1 57.0 14.1 58.0 1.1 59.0 8.5 60.0 1.2 62.0 10.2 67.0 2.2 68.0 1.7 69.0 5.4 70.0 2.6 82.0 1.0 83.0 5.3 84.0 2.3 85.0 9.1 86.0 1.0 88.0 1.9 102.0 1.4
400 MHz in CDCl3
90 MHz in CDCl3
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1H NMR 399.65 MHz C6 H13 N O2 0.05 ml : 0.5 ml CDCl3 1-nitrohexane 
Assign. Shift(ppm)
A 4.389 B 2.003 C 1.39 D 1.34 E 1.32 F 0.900
Hz ppm Int.1768.19 4.425 30 1761.23 4.407 573 1754.15 4.390 1000 1747.07 4.372 602 815.43 2.041 97 808.47 2.023 250 801.03 2.005 313 793.46 1.986 296 786.38 1.968 125 571.78 1.431 41 569.21 1.425 65 566.41 1.418 76 561.89 1.406 150 559.45 1.400 133 556.40 1.393 197 554.57 1.388 196 553.22 1.385 201 551.39 1.380 166 550.29 1.377 191 548.58 1.373 189 546.51 1.368 233 544.31 1.362 190 541.87 1.356 250 540.53 1.353 250 539.06 1.349 269 536.25 1.342 637 533.45 1.335 489 531.74 1.331 408 529.66 1.326 476 528.56 1.323 422 525.39 1.315 295 521.97 1.307 187 516.36 1.293 52 514.77 1.289 39 373.29 0.935 46 366.21 0.917 374 364.62 0.913 230 362.67 0.908 255 360.72 0.903 339 359.13 0.899 946 354.74 0.888 186 353.15 0.884 251 352.05 0.881 331 345.46 0.865 35
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1H NMR 89.56 MHz C6 H13 N O2 0.05 ml : 0.5 ml CDCl3 1-nitrohexane Assign. Shift(ppm)
A 4.379 B 1.99 C 1.5 to 1.24 D 0.91 400MHZ:HSP-41-326
Hz ppm Int.399.44 4.461 403 392.50 4.383 846 385.50 4.305 454 186.25 2.080 149 179.38 2.003 227 176.38 1.970 140 172.50 1.927 173 167.56 1.871 61 167.13 1.867 62 166.88 1.864 62 166.44 1.859 61 165.75 1.851 62 143.19 1.599 32 142.63 1.593 33 142.31 1.589 34 142.13 1.587 34 138.00 1.541 53 137.00 1.530 53 131.13 1.465 182 121.75 1.360 1000 119.13 1.331 796 117.75 1.315 755 104.63 1.169 47 104.44 1.167 47 102.63 1.146 36 101.75 1.137 36 101.44 1.133 36 100.94 1.128 36 100.50 1.123 36 99.94 1.116 35 99.63 1.113 35 99.13 1.107 35 98.19 1.097 36 97.75 1.092 36 97.00 1.084 38 94.19 1.052 45 93.63 1.046 46 86.06 0.961 294 80.38 0.898 702 75.69 0.846 170 75.31 0.841 169 74.31 0.830 174
in CDCl3
liquid film
4880 A,200 M,liquid
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