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Ethyl levulinate
SpectraBase Compound ID 6hp2vzlzrVC
InChI InChI=1S/C7H12O3/c1-3-10-7(9)5-4-6(2)8/h3-5H2,1-2H3
InChIKey GMEONFUTDYJSNV-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnubP9h6QpU
Name 4-Oxo-pentanoic acid ethyl ester
CAS Registry Number 539-88-8
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 144.078644243 u
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-3-10-7(9)5-4-6(2)8/h3-5H2,1-2H3
InChIKey GMEONFUTDYJSNV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 144.170 g/mol
Nominal Mass 144 u
Quality 971
Retention Index 987
SMILES C(CCC(=O)C)(OCC)=O
SPLASH splash10-0006-9100000000-7efe1680d119eece3a96
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Pentanoic acid,4-oxo-,ethyl ester Ethyl 4-oxo pentanoate
Technique GC/MS
Wiley ID DD2024_030570