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Alpha-Ketoisovaleric acid, sodium salt (13C5)

Catalog Number ACM1173018240
CAS 1173018-24-0
Structure Structure
Synonyms 2-Keto-3-methylbutyric acid-13C5 sodium salt
IUPAC Name sodium;3-(1-13C)methyl-2-oxo(1,2,3,4-13C4)butanoate
Molecular Weight 143.06
Molecular Formula 13C5H7NaO3
Canonical SMILES [13CH3][13CH]([13CH3])[13C](=O)[13C](=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+1,4+1,5+1;
InChI Key WIQBZDCJCRFGKA-JFGXUQBHSA-M
Melting Point 220-230 °C (428-446 °F) (dec.)
Purity 98%
Appearance White solid
Chemical Formula (*CH3)2*CH*CO*COONa
Isomeric SMILES [13CH3][13CH]([13CH3])[13C](=O)[13C](=O)[O-].[Na+]
Isotopic Enrichment 98 atom % 13C
Stability One year after receipt. Re-QC after one year.
Unlabeled CAS 3715-29-5
Unlabeled Synonyms 3-Methyl-2-oxobutyric acid sodium salt; 3-Methyl-2-oxobutanoic acid sodium salt; α-Ketoisovaleric acid sodium salt
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