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Back ChemicalBook Home>CAS DataBase List>498-94-2More Spectrum> Isonipecotic acid(498-94-2) IR2

498-94-2

Isonipecotic acid(498-94-2) IR2

Product NameIsonipecotic acid

CAS498-94-2

Molecular FormulaC6H11NO2

Molecular Weight129.16

InChIInChI=1S/C6H11NO2/c8-6(9)5-1-3-7-4-2-5/h5,7H,1-4H2,(H,8,9)

InChIKey SRJOCJYGOFTFLH-UHFFFAOYSA-N

SmilesN1CCC(C(O)=O)CC1

  • Isonipecotic acid(498-94-2) IR2
    Mass

    MS-NW-1620          
    4-piperidinecarboxylic acid
    C6H11NO2            (Mass of molecular ion:    129)
    

       Source Temperature: 200 °C
       Sample Temperature: 160 °C
       Direct, 75 eV
    

          15.0       2.5
          17.0       1.1
          18.0       5.2
          26.0       2.3
          27.0      14.2
          28.0      22.3
          29.0      22.2
          30.0      30.8
          39.0       9.2
          40.0       1.5
          41.0       7.3
          42.0      24.3
          43.0      23.1
          44.0      13.2
          45.0       3.2
          50.0       1.1
          51.0       1.8
          52.0       1.7
          53.0       5.4
          54.0       4.5
          55.0      33.7
          56.0     100.0
          57.0      84.5
          58.0       3.2
          67.0       3.1
          68.0       3.5
          69.0       2.7
          70.0       1.8
          71.0       1.2
          73.0       4.0
          74.0       1.2
          80.0       2.8
          81.0       1.4
          82.0      24.0
          83.0       8.8
          84.0      35.7
          85.0       2.8
          86.0       1.1
         100.0       6.3
         101.0       5.4
         111.0       1.7
         112.0       1.2
         114.0       1.0
         128.0      16.0
         129.0      31.3
         130.0       2.3
    

  • Isonipecotic acid(498-94-2) IR2

KBr disc

  • Isonipecotic acid(498-94-2) IR2

nujol mull

  • Isonipecotic acid(498-94-2) IR2

  • Isonipecotic acid(498-94-2) IR2

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