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MassMS-NW-6968 1,4-anhydro-D-glucitol C6H12O5 (Mass of molecular ion: 164)
Source Temperature: 200 °C Sample Temperature: 120 °C Direct, 75 eV
14.0 1.3 15.0 14.7 17.0 1.3 18.0 5.7 19.0 20.6 26.0 2.4 27.0 19.3 28.0 17.5 29.0 31.6 30.0 3.8 31.0 49.7 32.0 1.3 39.0 7.1 40.0 3.8 41.0 13.8 42.0 10.9 43.0 71.7 44.0 38.9 45.0 71.8 46.0 2.4 47.0 3.9 53.0 1.2 54.0 1.4 55.0 22.4 56.0 26.0 57.0 64.6 58.0 26.4 59.0 8.6 60.0 26.5 61.0 55.3 62.0 1.9 68.0 1.4 69.0 25.5 70.0 1.8 71.0 10.3 72.0 1.9 73.0 83.8 74.0 17.1 75.0 5.0 82.0 1.0 84.0 2.1 85.0 20.3 86.0 100.0 87.0 8.6 88.0 1.0 89.0 1.0 91.0 1.9 97.0 2.0 98.0 1.8 99.0 2.4 102.0 1.7 103.0 93.1 104.0 5.8 105.0 1.4 111.0 2.4 115.0 3.2 116.0 1.1 128.0 3.2 133.0 7.2 146.0 4.7
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C6 H12 O5 0.039 g : 0.5 ml DMSO-d6 1,4-anhydro-D-glucitol 
Assign. Shift(ppm)
A *1 5.00 B *1 4.82 C 4.50 D 4.37 E 3.95 F 3.91 G *2 3.90 J 3.64 L *3 3.567 M *2 3.440 N *3 3.36
Hz ppm Int.2001.71 5.009 830 1998.54 5.001 831 1929.44 4.828 977 1925.17 4.818 979 1800.66 4.506 603 1798.34 4.500 372 1795.29 4.493 570 1788.82 4.476 30 1750.85 4.381 431 1745.00 4.367 971 1739.26 4.352 451 1582.89 3.961 260 1579.10 3.952 500 1575.56 3.943 353 1566.89 3.921 742 1563.11 3.912 611 1558.11 3.899 480 1554.08 3.889 319 1470.70 3.680 39 1468.14 3.674 35 1465.21 3.667 38 1462.16 3.659 197 1459.47 3.652 314 1454.96 3.641 1000 1446.78 3.621 80 1443.24 3.612 44 1435.55 3.593 174 1434.94 3.591 172 1429.69 3.578 177 1428.83 3.576 172 1424.56 3.565 257 1422.12 3.559 227 1418.82 3.551 241 1416.38 3.545 212 1379.39 3.452 665 1370.36 3.429 622 1363.89 3.413 38 1362.67 3.410 35 1362.06 3.409 37 1353.03 3.386 150 1346.92 3.371 261 1341.55 3.357 229 1335.82 3.343 235 1329.96 3.328 114
D2O
in DMSO-d6
KBr disc
nujol mull
4880 A,200 M,powder
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