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2-Keto-3-methylbutyric acid-3-[d] sodium salt hydrate

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General Information
Catalog: BLP-005681
Molecular Formula: C5H6DNaO3
Molecular Weight: 139.10 (anhydrous basis)

Chemical Structure

Description	2-Keto-3-methylbutyric acid-3-[d] sodium salt hydrate is intended for use as an internal standard for α-Keto Isovaleric Acid Sodium Salt. α-Keto Isovaleric Acid Sodium Salt can be used in studies involving the selective isotopic unlabelling of proteins providing important residue-type information.
Synonyms	α-Keto-3-methyl-butyric acid-3-d sodium hydrate; α-Ketoisovaleric acid-3-d sodium salt hydrate; 2-Ketoisovaleric acid-3-d sodium salt hydrate
IUPAC Name	sodium;3-deuterio-3-methyl-2-oxobutanoate;hydrate
Related CAS	3715-29-5 (unlabelled)
Canonical SMILES	CC(C)C(=O)C(=O)[O-].[Na+]
InChI	InChI=1S/C5H8O3.Na.H2O/c1-3(2)4(6)5(7)8;;/h3H,1-2H3,(H,7,8);;1H2/q;+1;/p-1/i3D;
InChI Key	PGCNKYBBFKQNIR-KIGHCJKZSA-M
Purity	97% by CP; 98% atom D
Appearance	Solid