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630-18-2

三甲基乙腈(630-18-2)质谱(MS)

产品名称:三甲基乙腈

CAS:630-18-2

分子式:C5H9N

分子量: 83.13

InChI:InChI=1S/C5H9N/c1-5(2,3)4-6/h1-3H3

InChIKey: JAMNHZBIQDNHMM-UHFFFAOYSA-N

Smiles:C(#N)C(C)(C)C

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    Mass

    MS-NW-6396          
    pivalonitrile
    C5H9N               (Mass of molecular ion:     83)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          15.0       4.8
          18.0       2.3
          26.0       2.3
          27.0      10.4
          28.0       3.4
          29.0       3.1
          37.0       2.2
          38.0       2.8
          39.0      14.2
          40.0       5.5
          41.0      80.0
          42.0     100.0
          43.0       3.2
          51.0       2.0
          52.0       5.0
          53.0       1.2
          54.0       1.4
          55.0       2.3
          57.0       1.2
          64.0       1.5
          66.0       3.7
          67.0      15.5
          68.0      48.5
          69.0       2.6
          82.0       4.4
    

parameter in CCl4

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    1H NMR 300 MHz
    C5 H9 N in CCl4
    pivalonitrile
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 1.44 KUNTZ,I.D. ET AL. J.CHEM.PHYS. 35, 1533 (1961)

         Hz     ppm     Int.
    

        432.00   1.440   1000
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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