2-CARENE(554-61-0) 13C NMR
Molecular FormulaC10H16
Molecular Weight136.23
InChIInChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h6,8-9H,4-5H2,1-3H3
InChIKey IBVJWOMJGCHRRW-UHFFFAOYSA-N
SmilesC12C(C1(C)C)CCC(C)=C2
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MassMS-NW-9408 2-carene C10H16 (Mass of molecular ion: 136)
Source Temperature: 250 °C Sample Temperature: 160 °C Reservoir, 75 eV
27.0 10.6 29.0 9.6 39.0 16.4 40.0 2.8 41.0 22.4 42.0 1.5 43.0 21.4 50.0 1.4 51.0 6.0 52.0 2.7 53.0 9.4 54.0 1.1 55.0 10.0 58.0 1.3 59.0 1.5 63.0 2.0 65.0 7.4 66.0 1.8 67.0 9.3 68.0 2.9 69.0 2.0 77.0 33.3 78.0 5.3 79.0 38.6 80.0 8.4 81.0 5.9 82.0 1.4 91.0 40.5 92.0 12.5 93.0 100.0 94.0 10.9 95.0 3.6 103.0 2.7 105.0 20.3 106.0 5.4 107.0 14.4 108.0 6.3 109.0 3.5 115.0 1.1 117.0 1.3 119.0 6.4 120.0 1.1 121.0 90.4 122.0 9.1 123.0 1.1 134.0 1.0 135.0 1.4 136.0 55.0 137.0 6.8
400 MHz in CDCl3
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1H NMR 399.65 MHz C10 H16 0.05 ml : 0.5 ml CDCl3 2-carene 
Assign. Shift(ppm)
A 5.543 B *1 1.93 C *2 1.82 D *2 1.69 E 1.658 F *1 1.60 G *3 1.059 J 0.943 K *3 0.854 L 0.807
Hz ppm Int.2219.48 5.554 39 2218.26 5.551 68 2216.67 5.547 75 2215.21 5.543 73 2213.75 5.540 77 2212.28 5.536 68 2210.82 5.532 40 763.18 1.910 32 756.96 1.895 35 748.54 1.873 43 742.80 1.859 35 741.58 1.856 39 734.99 1.840 67 728.52 1.823 60 727.54 1.821 81 721.56 1.806 74 719.85 1.802 33 715.21 1.790 37 712.52 1.783 34 682.01 1.707 37 679.32 1.700 35 674.19 1.687 60 671.39 1.680 46 668.70 1.674 66 663.57 1.661 397 662.72 1.659 469 661.25 1.655 381 660.28 1.653 218 657.10 1.645 52 655.27 1.640 63 648.56 1.623 38 647.83 1.621 39 638.55 1.598 37 630.62 1.578 32 423.22 1.059 888 418.46 1.048 40 384.16 0.962 43 379.52 0.950 46 375.24 0.939 55 370.97 0.929 55 341.55 0.855 1000 337.89 0.846 51 330.81 0.828 53 328.13 0.822 63 323.49 0.810 58 320.80 0.803 64 315.19 0.789 40 312.26 0.782 37
in CDCl3
liquid film
