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Back ChemicalBook Home>CAS DataBase List>626-36-8More Spectrum> Ethyl allophanate(626-36-8) 13C NMR

626-36-8

Ethyl allophanate(626-36-8) 13C NMR

Product NameEthyl allophanate

CAS626-36-8

Molecular FormulaC4H8N2O3

Molecular Weight132.12

InChIInChI=1S/C4H8N2O3/c1-2-9-4(8)6-3(5)7/h2H2,1H3,(H3,5,6,7,8)

InChIKey PIHPSKJRLDSJPX-UHFFFAOYSA-N

SmilesC(OCC)(=O)NC(N)=O

  • Ethyl allophanate(626-36-8) <sup>13</sup>C NMR
    Mass

    MS-NW-5040          
    ethyl allophanate
    C4H8N2O3            (Mass of molecular ion:    132)
    

       Source Temperature: 150 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          14.0       1.1
          15.0       4.2
          16.0       4.8
          17.0      21.0
          18.0      12.8
          19.0       1.5
          26.0       3.7
          27.0      18.9
          28.0       9.7
          29.0      44.7
          30.0       4.7
          31.0      24.2
          42.0       6.3
          43.0      29.7
          44.0     100.0
          45.0      43.2
          46.0       7.4
          60.0      18.3
          61.0      15.5
          62.0      44.5
          70.0       4.3
          74.0       9.7
          86.0       2.2
          87.0      15.1
          88.0      18.2
          89.0      14.2
         104.0       1.2
         105.0      82.3
         106.0       2.7
         117.0       2.5
         132.0      16.2
         133.0       1.3
    

DMSO-d6

  • Ethyl allophanate(626-36-8) <sup>13</sup>C NMR

KBr disc

  • Ethyl allophanate(626-36-8) <sup>13</sup>C NMR

nujol mull

  • Ethyl allophanate(626-36-8) <sup>13</sup>C NMR

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