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Back ChemicalBook Home>CAS DataBase List>60-80-0More Spectrum> Antipyrine(60-80-0) 13C NMR

Antipyrine(60-80-0) 13C NMR

Product NameAntipyrine

CAS60-80-0

Molecular FormulaC11H12N2O

Molecular Weight188.23

InChIInChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3

InChIKey VEQOALNAAJBPNY-UHFFFAOYSA-N

SmilesN1(C)C(C)=CC(=O)N1C1=CC=CC=C1


  • Mass

    MS-NW-8278          
    2,3-dimethyl-1-phenyl-3-pyrazolin-5-one
    C11H12N2O           (Mass of molecular ion:    188)
    

       Source Temperature: 150 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          15.0       3.5
          18.0       2.2
          27.0       2.6
          28.0       4.6
          29.0       1.1
          30.0       1.1
          39.0       6.2
          40.0       3.3
          41.0       5.9
          42.0       5.3
          43.0       3.0
          51.0       6.1
          52.0       1.1
          54.0       2.3
          55.0      13.3
          56.0      32.5
          57.0       1.6
          63.0       1.2
          64.0       3.7
          65.0       3.4
          67.0       4.9
          68.0       4.6
          69.0       2.3
          77.0      41.4
          78.0       3.3
          82.0       8.8
          83.0       1.2
          84.0       9.9
          91.0       5.6
          92.0       5.4
          93.0      12.4
          94.0       2.6
          96.0      68.8
          97.0       4.7
         103.0       1.2
         104.0       4.6
         105.0      20.1
         106.0      10.9
         107.0       1.5
         115.0       5.5
         116.0       3.7
         117.0       3.1
         118.0       3.5
         119.0       1.0
         121.0       2.3
         128.0       1.2
         129.0       3.2
         130.0       3.3
         131.0       2.0
         132.0       1.6
         142.0       1.3
         144.0       2.4
         145.0       2.7
         146.0       1.9
         157.0       1.0
         158.0       1.5
         159.0       5.2
         160.0       2.2
         173.0       6.8
         187.0      13.2
         188.0     100.0
         189.0      15.6
         190.0       1.3
    

in CDCl3



KBr disc



nujol mull



4880 A,200 M,powder



Antipyrine(60-80-0) 13C NMR Atlas of Related Products

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