N-DECYLCYCLOHEXANE(1795-16-0) MS
Product NameN-DECYLCYCLOHEXANE
CAS1795-16-0
Molecular FormulaC16H32
Molecular Weight224.43
InChIInChI=1S/C16H32/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h16H,2-15H2,1H3
InChIKey STWFZICHPLEOIC-UHFFFAOYSA-N
SmilesC1(CCCCCCCCCC)CCCCC1
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MassMS-NW-1015 decylcyclohexane C16H32 (Mass of molecular ion: 224)
Source Temperature: 260 °C Sample Temperature: 130 °C Reservoir, 75 eV
27.0 3.3 29.0 7.3 39.0 3.0 41.0 19.4 42.0 3.4 43.0 12.9 53.0 1.7 54.0 3.3 55.0 38.2 56.0 6.1 57.0 7.8 67.0 11.8 68.0 3.3 69.0 9.1 70.0 4.3 71.0 3.1 81.0 2.4 82.0 81.2 83.0 100.0 84.0 8.7 85.0 1.9 96.0 1.6 97.0 6.9 98.0 2.0 111.0 2.7 112.0 1.6 140.0 2.4 224.0 5.3
400 MHz in CDCl3
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1H NMR 399.65 MHz C16 H32 11.9 mg : 0.5 ml CDCl3 decylcyclohexane 
Assign. Shift(ppm)
A 1.74 to 1.590 B 1.29 to 1.240 C 1.22 D 1.18 to 1.130 E 1.13 F 0.879 G 0.85
Hz ppm Int.679.44 1.701 90 676.39 1.693 80 672.85 1.684 69 668.95 1.674 102 668.21 1.672 101 667.85 1.672 100 666.75 1.669 106 664.55 1.663 84 663.45 1.661 80 661.50 1.656 67 660.28 1.653 61 659.91 1.652 60 657.71 1.646 45 520.02 1.302 53 515.14 1.289 85 514.53 1.288 87 512.94 1.284 97 512.57 1.283 97 510.86 1.279 90 502.44 1.258 1000 491.21 1.230 98 490.72 1.228 99 490.36 1.227 98 489.14 1.224 102 483.64 1.211 56 482.18 1.207 49 479.86 1.201 74 476.93 1.194 80 474.73 1.188 66 471.31 1.180 44 467.04 1.169 114 465.58 1.165 130 463.38 1.160 91 462.52 1.158 90 460.08 1.152 106 459.72 1.151 106 457.89 1.146 88 457.52 1.145 88 454.35 1.137 69 453.74 1.136 68 447.75 1.121 32 444.82 1.114 34 358.76 0.898 122 355.71 0.891 66 354.98 0.889 64 351.93 0.881 355 349.61 0.875 59 349.00 0.874 55 344.97 0.864 176 339.60 0.850 31 338.75 0.848 33 337.65 0.845 31 337.28 0.844 31 336.55 0.843 33 334.35 0.837 44 333.25 0.834 47
in CDCl3
liquid film
