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返回ChemicalBook首页>CAS数据库列表>6038-19-3更多图谱> DL-高半胱氨酸硫内酯盐酸盐(6038-19-3)核磁图(13CNMR)

DL-高半胱氨酸硫内酯盐酸盐(6038-19-3)核磁图(13CNMR)

分子式:C4H8ClNOS

分子量: 153.63

InChI:InChI=1S/C4H7NOS.ClH/c5-3-1-2-7-4(3)6;/h3H,1-2,5H2;1H

InChIKey: ZSEGSUBKDDEALH-UHFFFAOYSA-N

Smiles:C1(N)CCSC1=O.Cl

400 MHz in D2O


  • 1H NMR 399.65 MHz
    C4 H7 N O S 0.037 g : 0.5 ml D2O
    DL-homocysteine thiolactone hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.344 B *1 3.536 C *1 3.481 D *2 2.846 E *2 2.284 SOLVENT PEAK REMOVED

         Hz     ppm     Int.
    

       1746.46   4.370    772
       1746.09   4.370    741
       1739.38   4.353    846
       1739.01   4.352    798
       1733.40   4.338    841
       1733.03   4.337    812
       1726.32   4.320    848
       1725.95   4.319    800
       1428.96   3.576    298
       1423.83   3.563    328
       1417.36   3.547    929
       1412.23   3.534   1000
       1405.64   3.518    814
       1400.63   3.505    910
       1399.66   3.503    807
       1398.32   3.499    784
       1392.21   3.484    662
       1391.85   3.483    668
       1390.75   3.480    789
       1388.18   3.474    327
       1387.70   3.473    312
       1386.72   3.470    330
       1380.74   3.455    251
       1380.25   3.454    250
       1379.15   3.451    259
       1150.76   2.880    277
       1149.29   2.876    321
       1145.75   2.867    304
       1144.17   2.863    414
       1142.21   2.859    357
       1138.55   2.849    505
       1137.08   2.846    594
       1133.18   2.836    344
       1131.71   2.832    462
       1131.23   2.831    437
       1129.76   2.827    388
       1126.10   2.818    306
       1124.63   2.815    316
        935.55   2.341    271
        928.10   2.323    301
        923.83   2.312    384
        922.97   2.310    455
        916.26   2.293    376
        915.65   2.292    447
        915.04   2.290    433
        911.25   2.281    434
        910.89   2.280    421
        910.03   2.278    379
        903.81   2.262    374
        903.32   2.261    407
        902.59   2.259    373
        898.32   2.248    237
        890.87   2.230    214
    

in D2O



KBr disc



nujol mull



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