DL-賴氨酸鹽酸鹽(70-53-1)核磁圖(¹³CNMR)

產(chǎn)品名稱:DL-賴氨酸鹽酸鹽

CAS:70-53-1

分子式:C6H14N2O2.ClH

分子量: 182.65

InChI:InChI=1S/C6H14N2O2.ClH/c7-4-2-1-3-5(8)6(9)10;/h5H,1-4,7-8H2,(H,9,10);1H

InChIKey: BVHLGVCQOALMSV-UHFFFAOYSA-N

Smiles:C(O)(=O)C(CCCCN)N.[H]Cl

Mass

MS-NW-0299          
DL-lysine monohydrochloride
C6H14N2O2 HCl       (Mass of molecular ion:    146)

   Source Temperature: 190 °C
   Sample Temperature:   0 °C
   Direct, 75 eV

      15.0       2.2
      16.0       2.1
      17.0       3.8
      18.0      14.4
      26.0       2.4
      27.0       9.9
      28.0      29.7
      29.0       8.1
      30.0     100.0
      31.0       2.2
      35.0       7.5
      36.0      60.4
      37.0       2.5
      38.0      19.9
      39.0       9.1
      40.0       2.6
      41.0      19.3
      42.0      18.5
      43.0      34.0
      44.0      13.9
      45.0       3.3
      46.0       2.0
      50.0       1.2
      51.0       1.9
      52.0       2.7
      53.0       3.5
      54.0      14.0
      55.0      25.1
      56.0      71.7
      57.0      13.4
      58.0       3.4
      59.0       4.2
      65.0       1.4
      66.0       1.8
      67.0       7.5
      68.0       3.9
      69.0       4.7
      70.0      10.3
      71.0       8.6
      72.0      57.7
      73.0       4.5
      74.0      12.5
      75.0       3.3
      79.0       1.7
      80.0       2.9
      81.0       3.2
      82.0      19.3
      83.0      33.1
      84.0      76.0
      85.0       6.0
      87.0       1.4
      88.0       1.5
      89.0       2.1
      93.0       2.5
      99.0       4.2
     100.0       5.4
     101.0       3.9
     109.0       2.5
     110.0       6.0
     111.0       7.2
     112.0       1.1
     117.0       1.8
     128.0       4.0
     129.0       7.1
     130.0       3.0

90 MHz in D2O

¹H NMR	89.56 MHz
C₆ H₁₄ N₂ O₂	0.044 g : 0.5 ml D₂O
DL-lysine monohydrochloride

    Assign.     Shift(ppm)

      B             3.764
      C             3.032
      D          1.95 to 1.34
     
     THE SOLVENT SIGNAL REMOVED.

     Hz     ppm     Int.

    343.38   3.835    351
    337.69   3.771    812
    331.69   3.704    487
    279.56   3.122    545
    272.81   3.047   1000
    265.25   2.962    857
    170.44   1.904    549
    167.63   1.872    732
    164.50   1.837    594
    161.94   1.809    679
    157.69   1.761    584
    155.38   1.735    551
    151.69   1.694    544
    151.50   1.692    544
    151.19   1.689    543
    149.13   1.666    583
    144.69   1.616    647
    142.38   1.590    574
    136.31   1.522    476

in D2O