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Back ChemicalBook Home>CAS DataBase List>76836-02-7More Spectrum> Disodium piperazine-1,4-diethanesulphonate(76836-02-7) IR1

Disodium piperazine-1,4-diethanesulphonate(76836-02-7) IR1

Product NameDisodium piperazine-1,4-diethanesulphonate

CAS76836-02-7

Molecular FormulaC8H16N2Na2O6S2

Molecular Weight346.33

InChIInChI=1S/C8H18N2O6S2.2Na/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16;;/h1-8H2,(H,11,12,13)(H,14,15,16);;/q;2*+1/p-2

InChIKey GMHSTJRPSVFLMT-UHFFFAOYSA-L

SmilesS([O-])(=O)(=O)CCN1CCN(CCS([O-])(=O)=O)CC1.[Na+].[Na+]

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1HNMR

13CNMR

IR1 



  •     Assign.     Shift(ppm)
    
      A             3.125
      B             2.825
      C             2.6
    Spectral Code: 1H NMR : 400 MHz in D2O



  •        ppm   Int.  Assign.
    
        52.91   565     1
        52.24  1000     2
        48.34   540     3
    Spectral Code: 13C NMR : D2O


  • Spectral Code: IR : KBr disc

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