5,5-DIETHYLBARBITURIC ACID SODIUM SALT(144-02-5) IR1
Product Name5,5-DIETHYLBARBITURIC ACID SODIUM SALT
CAS144-02-5
Molecular FormulaC8H13N2NaO3
Molecular Weight208.19
InChIInChI=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
SmilesC1(CC)(CC)C(=O)N=C([O-])NC1=O.[Na+]
90 MHz in D2O
-
1H NMR 89.56 MHz C8 H11 N2 Na O3 0.048 g : 0.5 ml D2O sodium 5,5-diethylbarbiturate 
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
KBr disc
nujol mull
4880 A,200 M,powder
