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ethyl 2-acetyl-5-oxo-2-(3-oxobutyl)hexanoate
SpectraBase Compound ID 55CLcPJp3u
InChI InChI=1S/C14H22O5/c1-5-19-13(18)14(12(4)17,8-6-10(2)15)9-7-11(3)16/h5-9H2,1-4H3
InChIKey YYSNCZIFHHUSCJ-UHFFFAOYSA-N
Mol Weight 270.32 g/mol
Molecular Formula C14H22O5
Exact Mass 270.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoqNzDZ0HYH
Name ethyl 2-acetyl-5-oxo-2-(3-oxobutyl)hexanoate
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.146723803 u
Formula C14H22O5
InChI InChI=1S/C14H22O5/c1-5-19-13(18)14(12(4)17,8-6-10(2)15)9-7-11(3)16/h5-9H2,1-4H3
InChIKey YYSNCZIFHHUSCJ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801443
Quality 506
SMILES C(C(=O)C)(C(OCC)=O)(CCC(C)=O)CCC(C)=O
SPLASH splash10-0wc9-1910000000-4ba377e2b8893b6afee7
Source of Spectrum K1-2018-6189-6189-4 (DOI: 10.1002/ejoc.201801443)
Wiley ID 1894396