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2-Fluoro-3-keto-valeric acid ethyl ester
SpectraBase Compound ID I0HpAdAXGdo
InChI InChI=1S/C7H11FO3/c1-3-5(9)6(8)7(10)11-4-2/h6H,3-4H2,1-2H3
InChIKey ODPHSEIVAPWGAZ-UHFFFAOYSA-N
Mol Weight 162.16 g/mol
Molecular Formula C7H11FO3
Exact Mass 162.069222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PxuFISeJSj
Name 2-Fluoro-3-keto-valeric acid ethyl ester
CAS Registry Number 759-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11FO3
InChI InChI=1S/C7H11FO3/c1-3-5(9)6(8)7(10)11-4-2/h6H,3-4H2,1-2H3
InChIKey ODPHSEIVAPWGAZ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo1018443
Molecular Weight 162.160 g/mol
SMILES C(C(=O)OCC)(F)C(=O)CC
SPLASH splash10-0a6r-9000000000-ef85cadeb6a6df6cbd8d
Source of Spectrum J-75-8315/SMS3-1c
Synonyms 2-Fluoro-3-oxopentanoic acid ethyl ester Ethyl 2-fluoro-3-oxopentanoate Ethyl 2-fluoranyl-3-oxidanylidene-pentanoate Ethyl 2-fluoro-3-oxo-pentanoate
Wiley ID 1751834