Welcome to chemicalbook!
+1 (818) 612-2111
Inquriy
Try our best to find the right business for you.
Do not miss inquiry messages Please log in to view all inquiry messages.

Welcome back!

Back ChemicalBook Home>CAS DataBase List>539-66-2More Spectrum> SODIUM ISOVALERATE(539-66-2) 13C NMR

539-66-2

SODIUM ISOVALERATE(539-66-2) 13C NMR

Product NameSODIUM ISOVALERATE

CAS539-66-2

Molecular FormulaC5H9NaO2

Molecular Weight124.11

InChIInChI=1S/C5H10O2.Na/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);/q;+1/p-1

InChIKey JJZAWYXASMCCLB-UHFFFAOYSA-M

SmilesC(C)(C)CC([O-])=O.[Na+]

90 MHz in D2O

  • SODIUM ISOVALERATE(539-66-2) <sup>13</sup>C NMR

    1H NMR 89.56 MHz
    C5 H9 Na O2 0.048 g : 0.5 ml D2O
    sodium isovalerate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.05 B 1.93 C 0.92

         Hz     ppm     Int.
    

        191.00   2.133     35
        189.88   2.121     55
        189.00   2.111     51
        185.50   2.072    157
        183.44   2.049    344
        181.94   2.032    395
        177.81   1.986     44
        175.19   1.957     71
        175.06   1.955     71
        174.75   1.952     70
        174.31   1.947     67
        169.75   1.896     40
        168.56   1.883     52
         92.69   1.035     39
         91.44   1.021     31
         90.31   1.009     42
         84.94   0.949   1000
         81.63   0.912    347
         78.50   0.877    799
         74.25   0.830     36
         73.63   0.823     32
         70.81   0.791     31
    

in D2O

  • SODIUM ISOVALERATE(539-66-2) <sup>13</sup>C NMR

KBr disc

  • SODIUM ISOVALERATE(539-66-2) <sup>13</sup>C NMR

nujol mull

  • SODIUM ISOVALERATE(539-66-2) <sup>13</sup>C NMR

SODIUM ISOVALERATE(539-66-2) 13C NMR Atlas of Related Products

×