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Back ChemicalBook Home>CAS DataBase List>17536-00-4More Spectrum> 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

17536-00-4

3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

Molecular FormulaC9H16N2

Molecular Weight152.24

InChIInChI=1S/C9H16N2/c1-6(2)8-5-9(7(3)4)11-10-8/h5-7H,1-4H3,(H,10,11)

InChIKey PJSJVTZSFIRYIZ-UHFFFAOYSA-N

SmilesN1C(C(C)C)=CC(C(C)C)=N1

  • 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1
    Mass

    MS-IW-8166          
    3,5-diisopropylpyrazole
    C9H16N2             (Mass of molecular ion:    152)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          27.0       2.3
          28.0       1.5
          39.0       2.9
          41.0       6.4
          42.0       2.2
          43.0       5.7
          53.0       1.6
          54.0       1.6
          60.0       1.6
          60.5       2.1
          61.0       2.5
          65.0       1.1
          66.0       1.5
          67.0       2.7
          68.0       3.8
          69.0       2.5
          77.0       1.5
          81.0       3.0
          82.0       1.1
          91.0       1.0
          93.0       1.1
          95.0      49.8
          96.0       3.4
         107.0       1.0
         109.0      10.7
         110.0       1.6
         121.0       5.8
         122.0       3.3
         123.0       1.3
         124.0      15.7
         125.0       1.4
         135.0       3.6
         137.0     100.0
         138.0       9.8
         150.0       1.0
         151.0      14.8
         152.0      40.9
         153.0       7.5
    

400 MHz in CDCl3

  • 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

    1H NMR 399.65 MHz
    C9 H16 N2 0.041 g : 0.5 ml CDCl3
    3,5-diisopropylpyrazole
    ChemicalStructure
        Assign.     Shift(ppm)
    A 5.853 B 2.940 C 1.57 D 1.247

         Hz     ppm     Int.
    

       2339.23   5.854    163
       1189.45   2.977     28
       1182.37   2.959     68
       1175.54   2.942     92
       1168.58   2.925     72
       1161.62   2.907     31
        625.85   1.566    223
        501.95   1.256   1000
        498.66   1.248     95
        495.00   1.239    973
    

in CDCl3

  • 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

KBr disc

  • 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

nujol mull

  • 3,5-DIISOPROPYLPYRAZOLE(17536-00-4) IR1

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