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MS-KW-0529 1,4-benzodioxane-6-carbaldehyde C9H8O3 (Mass of molecular ion: 164)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
26.0 1.9 27.0 3.1 28.0 2.8 29.0 2.4 38.0 1.7 39.0 1.7 43.0 1.0 50.0 7.5 51.0 17.8 52.0 12.4 53.0 3.8 55.0 1.0 62.0 2.1 63.0 5.2 64.0 1.1 65.0 1.2 68.0 1.7 74.0 3.7 75.0 2.5 77.0 3.4 78.0 1.1 79.0 25.6 80.0 21.5 81.0 3.1 91.0 1.9 107.0 8.1 108.0 12.4 109.0 2.4 119.0 1.1 135.0 14.3 136.0 4.2 137.0 3.2 149.0 6.6 163.0 90.1 164.0 100.0 165.0 10.1 166.0 1.0
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H8 O3 0.037 g : 0.5 ml CDCl3 1,4-benzodioxane-6-carbaldehyde Assign. Shift(ppm)
A 9.817 B 7.40 C 7.39 D 6.978 E *1 4.333 F *1 4.294
Hz ppm Int.
3923.65 9.818 1000 3923.19 9.817 986 2961.58 7.411 235 2959.59 7.406 492 2956.54 7.398 724 2954.71 7.394 835 2952.88 7.389 620 2950.90 7.384 240 2793.43 6.990 492 2789.31 6.980 76 2788.54 6.978 74 2788.09 6.977 70 2784.42 6.968 452 1737.52 4.348 233 1736.45 4.345 268 1734.16 4.340 462 1732.64 4.336 367 1730.80 4.331 521 1729.13 4.327 638 1728.36 4.325 649 1723.18 4.312 31 1719.51 4.303 663 1718.75 4.301 624 1717.07 4.297 508 1715.24 4.292 381 1713.71 4.289 473 1711.43 4.283 273 1710.51 4.281 237
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