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Back ChemicalBook Home>CAS DataBase List>1201-99-6More Spectrum> TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) 1H NMR

1201-99-6

TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) 1H NMR

Molecular FormulaC9H6Cl2O2

Molecular Weight217.05

InChIInChI=1S/C9H6Cl2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5H,(H,12,13)

InChIKey MEBWABJHRAYGFW-UHFFFAOYSA-N

SmilesC(O)(=O)C=CC1=CC=C(Cl)C=C1Cl

  • TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) <sup>1</sup>H NMR
    Mass

    MS-NW-6523          
    2,4-dichlorocinnamic acid
    C9H6Cl2O2           (Mass of molecular ion:    216)
    

       Source Temperature: 170 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          18.0       1.7
          27.0       1.0
          28.0       1.0
          37.0       2.6
          38.0       2.1
          39.0       1.7
          45.0       6.1
          49.0       2.8
          49.5       1.5
          50.0      11.2
          51.0       7.8
          53.0       1.4
          61.0       3.9
          62.0       4.6
          63.0       5.8
          64.0       1.0
          68.0       4.6
          69.0       2.2
          72.0       1.3
          73.0       3.6
          74.0      16.8
          75.0      16.4
          76.0       2.5
          84.0       2.2
          85.0       4.4
          86.0       2.1
          87.0       2.1
          89.0       6.3
          90.0       2.1
          97.0       2.1
          98.0       5.6
          99.0      21.5
         100.0       5.3
         101.0      10.8
         102.0       9.7
         103.0       1.1
         108.0       1.3
         109.0       5.4
         110.0       1.9
         111.0       3.0
         118.0       3.1
         123.0       1.2
         125.0      28.2
         126.0       2.6
         127.0       9.4
         134.0       1.1
         135.0      13.7
         136.0      16.5
         137.0      14.4
         138.0       6.0
         139.0       3.7
         159.0       1.7
         161.0       1.2
         170.0       4.5
         171.0       7.4
         172.0       3.8
         173.0       5.0
         174.0       1.0
         175.0       1.1
         181.0     100.0
         182.0      10.3
         183.0      34.3
         184.0       3.2
         199.0       2.9
         201.0       1.8
         216.0       9.6
         217.0       1.3
         218.0       6.9
         220.0       1.1
    

  • TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) <sup>1</sup>H NMR

KBr disc

  • TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) <sup>1</sup>H NMR

nujol mull

  • TRANS-2,4-DICHLOROCINNAMIC ACID(1201-99-6) <sup>1</sup>H NMR

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