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MS-NW-2020 phenyl beta-D-glucopyranoside C12H16O6 (Mass of molecular ion: 256)
Source Temperature: 200 °C Sample Temperature: 200 °C Direct, 75 eV
15.0 2.9 17.0 1.5 18.0 8.4 19.0 2.5 26.0 1.4 27.0 4.4 28.0 3.7 29.0 8.0 30.0 2.5 31.0 7.0 38.0 1.7 39.0 7.6 40.0 3.7 41.0 2.9 42.0 2.9 43.0 8.6 44.0 2.5 45.0 5.3 47.0 1.4 50.0 1.6 51.0 3.2 53.0 1.1 55.0 6.0 56.0 2.1 57.0 8.8 60.0 8.7 61.0 5.4 63.0 1.2 65.0 5.9 66.0 8.2 68.0 1.1 69.0 4.7 70.0 1.6 71.0 3.4 72.0 1.3 73.0 9.3 74.0 1.4 77.0 4.8 85.0 7.3 87.0 4.3 89.0 1.2 91.0 2.0 94.0 100.0 95.0 8.4 96.0 1.3 97.0 2.9 98.0 1.5 99.0 1.0 107.0 1.2 127.0 1.7 145.0 1.5 162.0 1.3
400 MHz in D2O
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1H NMR 399.65 MHz C12 H16 O6 0.032 g : 0.5 ml D2O phenyl beta-D-glucopyranoside Assign. Shift(ppm)
A 7.392 B 7.14 C 5.080 D *1 3.913 E *1 3.769 F 3.62 G 3.58 J 3.52
Hz ppm Int.
2963.13 7.415 421 2955.32 7.395 706 2947.02 7.375 595 2859.50 7.156 1000 2853.27 7.140 741 2851.07 7.134 696 2850.22 7.132 703 2847.05 7.124 225 2846.07 7.122 241 2034.06 5.090 528 2030.27 5.081 51 2026.61 5.071 551 1572.14 3.934 234 1570.07 3.929 266 1559.69 3.903 364 1557.62 3.898 348 1517.33 3.797 35 1514.28 3.790 291 1511.72 3.783 73 1509.16 3.777 342 1505.37 3.767 38 1504.88 3.766 38 1501.95 3.759 212 1496.70 3.746 244 1458.01 3.649 142 1448.85 3.626 446 1445.80 3.618 57 1440.31 3.604 889 1436.77 3.596 187 1432.37 3.585 677 1430.30 3.579 367 1427.00 3.571 263 1424.80 3.566 244 1423.34 3.562 241 1420.41 3.555 44 1419.80 3.553 41 1419.31 3.552 41 1419.07 3.551 41 1415.16 3.541 418 1410.77 3.531 38 1406.37 3.520 304 1396.85 3.496 139
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