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Levulinic acid, 2-methyl-, ethyl ester
SpectraBase Compound ID BkisdAkgzKD
InChI InChI=1S/C8H14O3/c1-4-11-8(10)6(2)5-7(3)9/h6H,4-5H2,1-3H3
InChIKey KDAUHJMEXOZJRQ-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZfFZxyznim
Name Levulinic acid, 2-methyl-, ethyl ester
CAS Registry Number 4749-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-4-11-8(10)6(2)5-7(3)9/h6H,4-5H2,1-3H3
InChIKey KDAUHJMEXOZJRQ-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(C(CC(C)=O)C)(OCC)=O
SPLASH splash10-0006-9200000000-450c3d8300d4dedea189
Source of Spectrum F-45-5950-0
Synonyms Pentanoic acid, 2-methyl-4-oxo-, ethyl ester Ethyl 2-methyl-4-oxopentanoate 2-Methyl-4-oxopentanoic acid ethyl ester 4-keto-2-methyl-valeric acid ethyl ester Ethyl 2-methyl-4-oxidanylidene-pentanoate
Wiley ID 1155163