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4-Methyl-2-oxovaleric acid sodium salt

View entire compound with spectra: 2 NMR, and 2 FTIR

4-Methyl-2-oxovaleric acid sodium salt
SpectraBase Compound ID 4biE5ueA9j7
InChI InChI=1S/C6H10O3.Na/c1-4(2)3-5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/q;+1/p-1
InChIKey IXFAZKRLPPMQEO-UHFFFAOYSA-M
Mol Weight 152.12 g/mol
Molecular Formula C6H9NaO3
Exact Mass 152.044938 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CNdc9OmWcSq
Name 4-Methyl-2-oxopentanoic acid sodium salt
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W387101
Lot Number 02410KE
CAS Registry Number 4502-00-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NaO3
InChI InChI=1S/C6H10O3.Na/c1-4(2)3-5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/q;+1/p-1
InChIKey IXFAZKRLPPMQEO-UHFFFAOYSA-M
Molecular Weight 152.125 g/mol
Purity 97%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Sodium 4-methyl-2-oxovalerate; alpha-Ketoisocaproic acid sodium salt; 4-Methyl-2-oxopentanoic acid sodium salt; 4-Methyl-2-oxovaleric acid sodium salt; Ketoleucine sodium salt
Technique Mull
Wiley ID SIAL_FF-FTIR_002027