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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>616-04-6更多圖譜> 甲酰乙內(nèi)脲(616-04-6)紅外圖譜(IR1)

616-04-6

甲酰乙內(nèi)脲(616-04-6)紅外圖譜(IR1)

產(chǎn)品名稱:甲酰乙內(nèi)脲

CAS:616-04-6

分子式:C4H6N2O2

分子量: 114.1

InChI:InChI=1S/C4H6N2O2/c1-6-2-3(7)5-4(6)8/h2H2,1H3,(H,5,7,8)

InChIKey: RHYBFKMFHLPQPH-UHFFFAOYSA-N

Smiles:C1(=O)N(C)CC(=O)N1

  • 圖譜
    Mass 

    MS-KW-0505          
1-methyl-2,4-imidazolidinedione
C4H6N2O2            (Mass of molecular ion:    114)


       Source Temperature: 150 °C
   Sample Temperature: 120 °C
   Direct, 75 eV


          15.0       3.9
      18.0       1.1
      28.0       4.6
      29.0       1.1
      30.0       3.6
      40.0       1.8
      41.0       3.8
      42.0      40.7
      43.0      36.8
      44.0       2.0
      56.0       1.3
      70.0       3.8
      71.0       5.0
      86.0       7.7
     114.0     100.0
     115.0       5.6

400 MHz in DMSO-d6

  • 圖譜

    1H NMR 399.65 MHz
    C4 H6 N2 O2 0.042 g : 0.5 ml DMSO-d6
    1-methyl-2,4-imidazolidinedione
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A            10.7
      B             3.904
      C             2.787
  

         Hz     ppm     Int.


       4273.64  10.694     33
   1560.40   3.905    628
   1114.39   2.789   1000

in D2O

in DMSO-d6

  • 圖譜

  • 圖譜

KBr disc

  • 圖譜

4880 A,200 M,powder

  • 圖譜

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