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Back ChemicalBook Home>CAS DataBase List>94-16-6More Spectrum> P-AMINOHIPPURIC ACID SODIUM SALT(94-16-6) IR1

P-AMINOHIPPURIC ACID SODIUM SALT(94-16-6) IR1

Molecular FormulaC9H11N2NaO3

Molecular Weight218.19

InChIInChI=1S/C9H10N2O3.Na.H/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13;;/h1-4H,5,10H2,(H,11,14)(H,12,13);;

InChIKey IGACXVXMVJUFOL-UHFFFAOYSA-N

SmilesC(C1C=CC(N)=CC=1)(=O)NCC(=O)O.[NaH]

400 MHz in DMSO-d6


  • 1H NMR 399.65 MHz
    C9 H9 N2 Na O3 0.039 g : 0.5 ml DMSO-d6
    sodium p-aminohippurate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.559 B 7.53 C 6.556 D 5.62 E 3.595 F 3.6

         Hz     ppm     Int.
    

       3025.51   7.571    716
       3016.85   7.549    780
       3014.04   7.542    183
       3013.18   7.540    185
       3008.30   7.528    297
       3003.78   7.517    153
       2624.63   6.568    809
       2615.97   6.546    806
       2613.53   6.540    109
       2245.73   5.620    519
       1438.96   3.601    583
       1434.33   3.589    587
       1421.02   3.556   1000
    

in DMSO-d6



KBr disc



nujol mull



4880 A,200 M,powder



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