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返回ChemicalBook首页>CAS数据库列表>54947-34-1更多图谱> D-葡糖胺肟盐酸盐(54947-34-1)核磁图(13CNMR)

54947-34-1

D-葡糖胺肟盐酸盐(54947-34-1)核磁图(13CNMR)

分子式:C6H15ClN2O5

分子量: 230.65

InChI:InChI=1/C6H14N2O5.ClH/c7-3(1-8-13)5(11)6(12)4(10)2-9;/h1,3-6,9-13H,2,7H2;1H/b8-1+;/t3-,4+,5+,6+;/s3

InChIKey: FBSKNFHFTDIXRN-FAXIAXCVNA-N

Smiles:[C@@H](O)([C@@H](N)/C=N/O)[C@H](O)[C@H](O)CO.Cl |&1:0,2,7,9,r|

400 MHz in D2O

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C6 H14 N2 O5 0.030 g : 0.5 ml D2O
    D-(+)-glucosamine oxime hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.608 B 4.24 C 4.23 D *1 3.843 E 3.782 F *1 3.68 G 3.65 ASSIGNED BY H-H COSY. THE SOLVENT SIGNAL SUPPRESSED.

         Hz     ppm     Int.
    

       3043.21   7.615    778
       3038.57   7.604    838
       1705.57   4.268    208
       1703.61   4.263    120
       1701.05   4.257    187
       1698.73   4.251    628
       1694.09   4.239    719
       1691.04   4.232    846
       1690.06   4.229   1000
       1683.23   4.212    293
       1546.26   3.870    301
       1543.58   3.863    431
       1534.42   3.840    375
       1531.74   3.833    588
       1521.48   3.808    196
       1520.02   3.804    157
       1518.80   3.801    189
       1515.63   3.793    235
       1512.70   3.786    375
       1509.77   3.778    324
       1506.59   3.770    347
       1503.91   3.764    360
       1476.68   3.695    459
       1473.02   3.686    204
       1472.41   3.685    200
       1469.85   3.678    737
       1468.63   3.675    868
       1464.97   3.666    532
       1460.69   3.655    473
       1459.11   3.651    667
    

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    1H NMR 399.65 MHz
    C6 H14 N2 O5 0.037 g : 0.5 ml DMSO-d6
    D-(+)-glucosamine oxime hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 11.5 B 7.393 C 3.954 D 3.871 E *1 3.582 F 3.51 G *1 3.45 J 3.293 THE SIGNAL F OVERLAPPED BY H2O SIGNAL. ASSIGNED BY C-H COSY.

         Hz     ppm     Int.
    

       4589.97  11.485     50
       4589.60  11.485     54
       4579.53  11.459    351
       4569.27  11.434     47
       4568.90  11.433     45
       2957.96   7.402    994
       2952.09   7.387   1000
       2161.91   5.410     71
       1814.26   4.540     69
       1585.49   3.968    302
       1576.88   3.946    454
       1553.62   3.888    464
       1547.76   3.873    465
       1545.01   3.866    319
       1539.15   3.852    283
       1439.32   3.602    329
       1436.76   3.596    384
       1428.52   3.575    451
       1425.95   3.568    474
       1413.31   3.537    411
       1408.18   3.524    518
       1404.89   3.516    585
       1401.59   3.508    498
       1400.86   3.506    486
       1399.39   3.502    557
       1396.64   3.495    512
       1384.01   3.464    502
       1378.69   3.450    378
       1373.02   3.436    360
       1320.63   3.305    523
       1319.90   3.303    510
       1311.84   3.283    419
       1311.11   3.281    417
    

in DMSO-d6

in D2O

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KBr disc

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nujol mull

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