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144-02-5

巴比妥钠(144-02-5)红外图谱(IR2)

产品名称:巴比妥钠

CAS:144-02-5

分子式:C8H13N2NaO3

分子量: 208.19

InChI:InChI=1S/C8H12N2O3.Na/c1-3-8(4-2)5(11)9-7(13)10-6(8)12;/h3-4H2,1-2H3,(H2,9,10,11,12,13);/q;+1/p-1

InChIKey: RGHFKWPGWBFQLN-UHFFFAOYSA-M

Smiles:C1(CC)(CC)C(=O)N=C([O-])NC1=O.[Na+]

90 MHz in D2O

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    1H NMR 89.56 MHz
    C8 H11 N2 Na O3 0.048 g : 0.5 ml D2O
    sodium 5,5-diethylbarbiturate
    ChemicalStructure
        Assign.     Shift(ppm)
    B 1.864 C 0.759 THE SOLVENT SIGNAL REMOVED.

         Hz     ppm     Int.
    

        179.31   2.003     97
        171.44   1.915    382
        164.00   1.832    436
        157.06   1.754    155
         75.06   0.839    487
         67.81   0.758   1000
         60.19   0.673    351
    

in D2O

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KBr disc

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nujol mull

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4880 A,200 M,powder

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