Synonym: α-Keto-butyric acid-4-13C,3,3,4,4,4-d5 sodium; α-Ketobutyric acid-4-13C,3,3,4,4,4-d5 sodium salt; 2-Oxobutanoic acid-4-13C.3,3,4,4,5-d5 sodium salt; Sodium α-ketobutyrate-4-13C,3,3,4,4,4-d5
Empirical Formula (Hill Notation): 13CC3D5NaO3 · xH2O
Molecular Weight: 130.09 (anhydrous basis)
MDL Number: MFCD05664358
Linear Formula: 13CD3CD2COCO2Na · xH2O
Product Type: Chemical
assay |
98% (CP) |
form |
solid |
InChI |
1S/C4H6O3.Na.H2O/c1-2-3(5)4(6)7;;/h2H2,1H3,(H,6,7);;1H2/q;+1;/p-1/i1+1D3,2D2;; |
InChI key |
PVLJVKQSCAHPPR-RWBNLZSCSA-M |
isotopic purity |
48-70 atom % D (13CD3) |
|
97 atom % D (CD2) |
|
99 atom % 13C |
mass shift |
M+6 |
mp |
210 °C (dec.) (lit.) |
SMILES string |
O.[Na+].[2H][13C]([2H])([2H])C([2H])([2H])C(=O)C([O-])=O |
technique(s) |
bio NMR: suitable |
Packaging: |
100 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 . |
Purity |
98% (CP) |
mp |
210 °C (dec.) (lit.) |
UNSPSC |
12352106 |