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Back ChemicalBook Home>CAS DataBase List>114-63-6More Spectrum> Sodium 4-hydroxybenzoate (114-63-6) IR1

114-63-6

Sodium 4-hydroxybenzoate (114-63-6) IR1

Product NameSodium 4-hydroxybenzoate

CAS114-63-6

Molecular FormulaC7H6O3.Na

Molecular Weight161.11

InChIInChI=1S/C7H6O3.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1

InChIKey ZLVSYODPTJZFMK-UHFFFAOYSA-M

SmilesC1(C=CC(O)=CC=1)C([O-])=O.[Na+]

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1HNMR

13CNMR

IR1

IR2

400 MHz in DMSO-d6

  • Sodium 4-hydroxybenzoate (114-63-6) IR1

    1H NMR 399.65 MHz
    C7 H5 Na O3 0.040 g : 0.5 ml DMSO-d6
    sodium p-hydroxybenzoate
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.796
      B             6.731
  

         Hz     ppm     Int.


       3120.24   7.808    919
   3111.82   7.787   1000
   2694.75   6.743    991
   2686.14   6.722   1000

in DMSO-d6

in D2O

  • Sodium 4-hydroxybenzoate (114-63-6) IR1

  • Sodium 4-hydroxybenzoate (114-63-6) IR1

KBr disc

  • Sodium 4-hydroxybenzoate (114-63-6) IR1

nujol mull

  • Sodium 4-hydroxybenzoate (114-63-6) IR1

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