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MS-IW-7681 1,3-dimethylbutyl acetate C8H16O2 (Mass of molecular ion: 144)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 2.1 27.0 4.7 29.0 3.6 39.0 5.3 40.0 1.1 41.0 26.2 42.0 8.6 43.0 100.0 44.0 3.6 45.0 6.8 53.0 1.2 55.0 5.6 56.0 9.2 57.0 4.8 58.0 6.0 59.0 3.2 60.0 1.7 61.0 7.6 67.0 1.4 69.0 55.0 70.0 3.1 83.0 2.0 84.0 33.0 85.0 8.5 87.0 48.3 88.0 2.2 100.0 2.3 101.0 2.9 102.0 5.2 129.0 2.0
400 MHz in CDCl3
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1H NMR 399.65 MHz C8 H16 O2 0.05 ml : 0.5 ml CDCl3 1,3-dimethylbutyl acetate Assign. Shift(ppm)
A 4.990 B 2.018 C 1.64 D *1 1.55 E *1 1.268 F 1.200 G *2 0.907 J *2 0.899
Hz ppm Int.
2004.52 5.016 43 1999.27 5.003 48 1998.29 5.001 52 1995.97 4.995 47 1993.16 4.988 49 1990.97 4.982 49 1989.87 4.980 51 1984.74 4.967 42 806.52 2.019 1000 660.52 1.653 42 659.18 1.650 33 654.05 1.637 49 652.83 1.634 51 647.58 1.621 39 646.36 1.618 56 640.01 1.602 41 634.40 1.588 63 628.42 1.573 30 626.10 1.567 57 620.73 1.554 76 614.87 1.539 53 612.43 1.533 69 606.32 1.518 52 519.90 1.301 61 514.89 1.289 72 512.08 1.282 64 506.96 1.269 73 506.35 1.267 80 501.22 1.255 57 498.29 1.247 46 493.16 1.234 49 482.67 1.208 592 476.44 1.193 575 365.84 0.916 528 362.55 0.908 497 359.13 0.899 508 355.96 0.891 463
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