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52-52-8

環(huán)亮氨酸(52-52-8)紅外圖譜(IR2)

產(chǎn)品名稱:環(huán)亮氨酸

CAS:52-52-8

分子式:C6H11NO2

分子量: 129.16

InChI:InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9)

InChIKey: NILQLFBWTXNUOE-UHFFFAOYSA-N

Smiles:C1(N)(C(O)=O)CCCC1

  • 圖譜
    Mass 

    MS-NW-9342          
1-amino-1-cyclopentanecarboxylic acid
C6H11NO2 H2O        (Mass of molecular ion:    129)


       Source Temperature: 240 °C
   Sample Temperature: 140 °C
   Direct, 75 eV


          15.0       1.9
      17.0       1.5
      18.0      12.0
      27.0       4.2
      28.0      12.3
      29.0       3.5
      30.0       9.6
      39.0       5.6
      40.0       1.5
      41.0      13.4
      42.0      12.5
      43.0       2.4
      44.0       1.6
      45.0       1.0
      53.0       1.2
      54.0      12.0
      55.0       9.5
      56.0       6.1
      57.0       3.1
      65.0       1.7
      67.0      19.2
      68.0       1.7
      82.0       3.5
      83.0       2.7
      84.0     100.0
      85.0       6.1
      87.0       3.3
     100.0       8.6

400 MHz in D2O

  • 圖譜

    1H NMR 399.65 MHz
    C6 H11 N O2 0.037 g : 0.5 ml D2O
    1-amino-1-cyclopentanecarboxylic acid
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A     *1      2.214
      B     *1      1.87
      C             1.84
  

         Hz     ppm     Int.


        892.70   2.234    364
    886.96   2.220    430
    885.38   2.216    398
    879.52   2.201    389
    878.05   2.198    339
    876.34   2.193    275
    758.91   1.899    571
    757.45   1.896    540
    754.39   1.888    831
    751.71   1.881    569
    748.17   1.873    821
    743.29   1.860   1000
    741.21   1.855    811
    736.57   1.844    531
    734.13   1.837    442
    731.32   1.830    407
    728.76   1.824    450
    723.75   1.811    403

in D2O

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

  • 圖譜

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