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(+/-)-3-methyl-2-oxovaleric acid, sodium salt

View entire compound with spectra: 6 NMR, 5 FTIR, and 1 Raman

(+/-)-3-methyl-2-oxovaleric acid, sodium salt
SpectraBase Compound ID 3u7GQGmtSoz
InChI InChI=1S/C6H10O3.Na/c1-3-4(2)5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/q;+1/p-1
InChIKey SMDJDLCNOXJGKC-UHFFFAOYSA-M
Mol Weight 152.12 g/mol
Molecular Formula C6H9NaO3
Exact Mass 152.044938 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FHk1bKp5Qq4
Name 3-Methyl-2-oxopentanoic acid sodium salt
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 198978
CAS Registry Number 3715-31-9
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/c1-3-4(2)5(7)6(8)9;/h4H,3H2,1-2H3,(H,8,9);/q;+1/p-1
InChIKey SMDJDLCNOXJGKC-UHFFFAOYSA-M
Observed nucleus 13C
Purity >=98%
Solvent D2O
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Keto-3-methylvaleric acid sodium salt 3-Methyl-2-oxopentanoic acid sodium salt Ketoisoleucine sodium salt
Wiley ID SIAL_13CNMR_002884