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MassMS-IW-3852 2-methylhexanoic acid C7H14O2 (Mass of molecular ion: 130)
Source Temperature: 200 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 10.1 28.0 3.7 29.0 12.3 30.0 2.0 39.0 7.3 40.0 1.2 41.0 20.6 42.0 4.5 43.0 32.0 44.0 1.2 45.0 6.8 53.0 1.5 55.0 10.1 56.0 6.3 57.0 9.0 59.0 2.0 60.0 6.7 69.0 3.2 70.0 2.0 73.0 16.9 74.0 100.0 75.0 4.2 83.0 1.1 85.0 4.1 87.0 29.6 88.0 2.0 101.0 4.2 115.0 1.0
400 MHz in CDCl3
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1H NMR 399.65 MHz C7 H14 O2 0.05 ml : 0.5 ml CDCl3 2-methylhexanoic acid 
Assign. Shift(ppm)
Q 11.83 B 2.455 C 1.685 D 1.441 E 1.34 F 1.31 G 1.180 J 0.901
Hz ppm Int.992.21 2.483 79 985.07 2.465 149 978.29 2.448 154 971.33 2.431 89 688.89 1.724 48 687.97 1.722 42 685.04 1.715 36 681.56 1.706 68 680.28 1.703 58 677.35 1.695 53 674.60 1.688 89 672.77 1.684 66 669.84 1.677 52 667.09 1.670 86 662.70 1.659 34 661.05 1.655 31 659.58 1.651 40 658.12 1.647 33 585.58 1.466 70 583.75 1.461 46 581.74 1.456 39 578.81 1.449 92 571.85 1.431 72 564.70 1.413 60 558.66 1.398 32 544.55 1.363 38 539.24 1.350 126 537.23 1.345 145 533.93 1.336 422 529.90 1.326 360 526.42 1.318 516 522.94 1.309 264 519.09 1.299 190 514.33 1.287 47 512.13 1.282 50 475.32 1.190 1000 468.36 1.172 963 367.61 0.920 298 360.65 0.903 654 357.72 0.896 235 356.26 0.892 179 353.51 0.885 255
in CDCl3
liquid film
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