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Back ChemicalBook Home>CAS DataBase List>5848-24-8More Spectrum> N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) 1H NMR

5848-24-8

N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) 1H NMR

Molecular FormulaC4H7N3S

Molecular Weight129.18

InChIInChI=1S/C4H7N3S/c1-6-4(8-2)7-3-5/h1-2H3,(H,6,7)

InChIKey MHGGQXIPBPGZFB-UHFFFAOYSA-N

SmilesC(=NC)(SC)NC#N

  • N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) <sup>1</sup>H NMR
    Mass

    MS-NW-9383          
    3-cyano-1,2-dimethylisothiourea
    C4H7N3S             (Mass of molecular ion:    129)
    

       Source Temperature: 140 °C
       Sample Temperature:  80 °C
       Direct, 75 eV
    

          15.0      11.5
          17.0       3.8
          18.0      19.6
          27.0       1.6
          28.0       9.9
          29.0       2.8
          30.0       8.4
          32.0       1.2
          41.0       1.8
          42.0       2.5
          43.0       1.2
          44.0       1.1
          45.0       8.6
          46.0       4.6
          47.0       9.0
          48.0       9.1
          53.0       2.9
          55.0      15.5
          56.0       3.8
          57.0      78.4
          58.0       5.3
          59.0       1.4
          62.0       1.4
          67.0       1.8
          68.0       5.0
          72.0       1.6
          73.0       1.2
          74.0       4.1
          80.0       1.8
          81.0       2.5
          82.0     100.0
          83.0       7.8
          85.0       2.0
          87.0       1.1
          89.0       3.5
          99.0       4.2
         129.0      36.4
         130.0       2.7
         131.0       1.7
    

  • N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) <sup>1</sup>H NMR

KBr disc

  • N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) <sup>1</sup>H NMR

nujol mull

  • N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) <sup>1</sup>H NMR

N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) 1H NMR Atlas of Related Products

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