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Back ChemicalBook Home>CAS DataBase List>628-94-4More Spectrum> ADIPAMIDE(628-94-4) MS

ADIPAMIDE(628-94-4) MS

Product NameADIPAMIDE

CAS628-94-4

Molecular FormulaC6H12N2O2

Molecular Weight144.17

InChIInChI=1S/C6H12N2O2/c7-5(9)3-1-2-4-6(8)10/h1-4H2,(H2,7,9)(H2,8,10)

InChIKey GVNWZKBFMFUVNX-UHFFFAOYSA-N

SmilesC(N)(=O)CCCCC(N)=O


  • Mass

    MS-NW-1688          
    adipamide
    C6H12N2O2           (Mass of molecular ion:    144)
    

       Source Temperature: 190 °C
       Sample Temperature: 170 °C
       Direct, 75 eV
    

          15.0       1.5
          16.0       1.3
          17.0       1.9
          18.0       6.4
          26.0       2.1
          27.0      13.2
          28.0       8.2
          29.0      13.1
          30.0       2.6
          39.0       9.5
          40.0       1.7
          41.0      25.0
          42.0       7.2
          43.0      35.3
          44.0     100.0
          45.0       5.9
          51.0       1.3
          52.0       1.2
          53.0       3.3
          54.0       7.9
          55.0      19.2
          56.0      10.5
          57.0      16.6
          58.0       1.6
          59.0      62.3
          60.0       3.2
          67.0       1.2
          68.0       5.2
          69.0       4.2
          71.0       1.2
          72.0      61.2
          73.0      22.6
          74.0       1.0
          81.0       1.1
          82.0       3.9
          83.0       3.8
          84.0       1.5
          85.0       9.8
          86.0      90.8
          87.0       4.7
          98.0       2.4
          99.0      44.4
         100.0       9.1
         101.0       2.3
         110.0       6.4
         111.0       4.2
         127.0      18.2
         128.0       3.5
         144.0       1.8
    

90 MHz in DMSO-d6


  • 1H NMR 89.56 MHz
    C6 H12 N2 O2 0.039 g : 0.5 ml DMSO-d6
    adipamide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.21 B 6.67 C 2.03 D 1.47

         Hz     ppm     Int.
    

        645.13   7.204    240
        597.00   6.666    248
        188.44   2.105    315
        188.00   2.100    316
        187.56   2.095    315
        186.88   2.087    319
        186.19   2.079    313
        184.44   2.060    396
        182.13   2.034   1000
        175.63   1.962    479
        172.25   1.924    163
        171.19   1.912    111
        139.31   1.556    151
        137.06   1.531    437
        133.50   1.491    534
        130.13   1.453    981
        126.81   1.416    454
        126.31   1.411    457
        123.88   1.384    251
        123.50   1.379    254
        122.94   1.373    260
    

DMSO-d6



KBr disc



nujol mull





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