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Back ChemicalBook Home>CAS DataBase List>6148-75-0More Spectrum> Sodium mesitylenesulfonate(6148-75-0) 13C NMR

Sodium mesitylenesulfonate(6148-75-0) 13C NMR

Molecular FormulaC9H11NaO3S

Molecular Weight222.24

InChIInChI=1S/C9H12O3S.Na/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;/h4-5H,1-3H3,(H,10,11,12);/q;+1/p-1

InChIKey AOJUNZYQOYSGHT-UHFFFAOYSA-M

SmilesS([O-])(=O)(=O)C1C(C)=CC(C)=CC=1C.[Na+]

90 MHz in D2O


  • 1H NMR 89.56 MHz
    C9 H11 Na O3 S 0.039 g : 0.5 ml D2O
    sodium mesitylenesulfonate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.990 B 2.575 C 2.229

         Hz     ppm     Int.
    

        626.13   6.992    231
        230.69   2.576   1000
        199.69   2.230    457
    

in D2O



KBr disc



nujol mull



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