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Levulinic acid

View entire compound with spectra: 8 NMR, 14 FTIR, 1 Raman, and 22 MS (GC)

Levulinic acid
SpectraBase Compound ID 1X7Y37pOFGU
InChI InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
InChIKey JOOXCMJARBKPKM-UHFFFAOYSA-N
Mol Weight 116.12 g/mol
Molecular Formula C5H8O3
Exact Mass 116.047344 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LRpHwIGfqhA
Name Levulinic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W262706
Lot Number 07217JE
CAS Registry Number 123-76-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O3
InChI InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
InChIKey JOOXCMJARBKPKM-UHFFFAOYSA-N
Molecular Weight 116.116 g/mol
Purity >=97%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-Oxopentanoic acid; 4-Oxovaleric acid
Technique Between salts
Wiley ID SIAL_FF-FTIR_000855