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Alpha-ketoisovaleric acid-[13C5,3-d] Sodium salt

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General Information
Catalog: BLP-007193
CAS: 420095-74-5
Molecular Formula: [13C]5H6DNaO3
Molecular Weight: 144.07

Chemical Structure

Synonyms	2-Keto-3-methylbutyric acid-13C5,3-d sodium salt
IUPAC Name	sodium;3-deuterio-3-(1-13C)methyl-2-oxo(1,2,3,4-13C4)butanoate
Related CAS	3715-29-5 (unlabelled)
Isomeric SMILES	[2H][13C]([13CH3])([13CH3])[13C](=O)[13C](=O)[O-].[Na+]
Canonical SMILES	CC(C)C(=O)C(=O)[O-].[Na+]
InChI	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
Purity	98% by CP; 98% atom 13C; 98% atom D
Solubility	Soluble in Methanol, Water
Appearance	White to Off-white Solid
Storage	Store at RT