1-DODECENE(112-41-4) Raman
Product Name1-DODECENE
CAS112-41-4
Molecular FormulaC12H24
Molecular Weight168.32
InChIInChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3
InChIKey CRSBERNSMYQZNG-UHFFFAOYSA-N
SmilesC=CCCCCCCCCCC
-
MassMS-NW-0436 1-dodecene C12H24 (Mass of molecular ion: 168)
Source Temperature: 240 °C Sample Temperature: 120 °C Reservoir, 75 eV
18.0 2.1 27.0 14.8 28.0 4.0 29.0 30.1 39.0 17.3 40.0 3.1 41.0 75.2 42.0 27.0 43.0 100.0 44.0 3.4 53.0 6.6 54.0 12.4 55.0 92.9 56.0 92.5 57.0 67.0 58.0 3.0 65.0 1.0 66.0 1.0 67.0 11.5 68.0 13.0 69.0 76.5 70.0 89.4 71.0 29.0 72.0 1.6 81.0 4.0 82.0 14.4 83.0 65.2 84.0 48.8 85.0 14.4 95.0 1.0 96.0 6.0 97.0 45.9 98.0 23.8 99.0 2.2 110.0 2.2 111.0 15.7 112.0 9.1 113.0 1.0 125.0 6.2 126.0 6.6 139.0 2.6 140.0 5.3 168.0 9.8 169.0 1.4
90 MHz in CDCl3
-
1H NMR 89.56 MHz C12 H24 0.04 ml : 0.5 ml CDCl3 1-dodecene 
Assign. Shift(ppm)
A 5.795 B 4.98 C 4.93 D 2.02 E 1.46 F 1.46 to 1.07 G 0.89
Hz ppm Int.535.19 5.976 31 525.25 5.865 39 517.94 5.784 52 508.06 5.673 60 501.56 5.601 34 455.63 5.088 51 454.69 5.077 51 454.13 5.071 35 453.25 5.061 95 451.81 5.045 47 447.56 4.998 40 446.38 4.985 83 445.19 4.971 62 444.00 4.958 47 437.50 4.885 46 436.44 4.874 89 436.06 4.869 87 435.25 4.860 61 434.63 4.853 48 434.13 4.848 36 185.94 2.077 45 185.63 2.073 45 185.06 2.067 43 184.75 2.063 43 183.06 2.044 33 182.50 2.038 32 179.44 2.004 52 130.50 1.458 30 129.88 1.451 32 125.69 1.404 52 125.00 1.396 52 113.50 1.268 1000 84.19 0.941 63 82.44 0.921 51 81.81 0.914 49 81.00 0.905 50 78.81 0.880 195 72.81 0.813 40
in CDCl3
CCl4 solution
liquid film
4880 A,100M,liquid
