Synonym: α-Keto-3-methylbutyric acid-13C5,3-d sodium; α-Ketoisovaleric acid-13C5,3-d sodium salt; 2-Ketoisovaleric acid-13C5,3-d sodium salt; 3-Methyl-2-oxobutanoic acid-13C5,3-d sodium salt; Ketovaline-13C5,3-d sodium salt; Sodium α-ketoisovalerate-13C5,3-d; Sodium 3-methyl-2-oxobutyrate-13C5,3-d
CAS Number: 420095-74-5
Empirical Formula (Hill Notation): 13C5DH6NaO3
Molecular Weight: 144.07
MDL Number: MFCD04118216
Linear Formula: 13CH313CD(13CH3)13CO13CO2Na
Product Type: Chemical
form |
solid |
InChI |
1S/C5H8O3.Na/c1-3(2)4(6)5(7)8;/h3H,1-2H3,(H,7,8);/q;+1/p-1/i1+1,2+1,3+1D,4+1,5+1; |
InChI key |
WIQBZDCJCRFGKA-MLIDLTAPSA-M |
isotopic purity |
98 atom % D |
|
99 atom % 13C |
mass shift |
M+6 |
mp |
227-230 °C (lit.) |
Quality Level |
200 |
SMILES string |
[Na+].[2H][13C]([13CH3])([13CH3])[13C](=O)[13C]([O-])=O |
technique(s) |
bio NMR: suitable |
Packaging: |
250 mg in glass bottle |
Packaging: |
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service . |
mp |
227-230 °C (lit.) |
UNSPSC |
12352106 |