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Back ChemicalBook Home>CAS DataBase List>922-32-7More Spectrum> Creatine phosphate disodium salt(922-32-7) IR2

Creatine phosphate disodium salt(922-32-7) IR2

Product NameCreatine phosphate disodium salt

CAS922-32-7

Molecular FormulaC4H11N3NaO5P

Molecular Weight235.11

InChIInChI=1S/C4H10N3O5P.Na.H/c1-7(2-3(8)9)4(5)6-13(10,11)12;;/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12);;

InChIKey SHTITGDPKBKALB-UHFFFAOYSA-N

SmilesC(=N)(NP(O)(O)=O)N(C)CC(=O)O.[NaH]

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1HNMR

13CNMR

IR1

IR2

400 MHz in D2O


  • 1H NMR 399.65 MHz
    C4 H8 N3 Na2 O5 P 0.033 g : 0.5 ml D2O
    phosphocreatine disodium salt
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             3.955
      B             3.047
     
     SOLVENT PEAK REMOVED
  

         Hz     ppm     Int.


       1580.81   3.956    566
   1217.90   3.048   1000

in D2O



KBr disc



nujol mull



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