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(E)-Ethyl 3-methyl-4-oxooct-2-enoate
SpectraBase Compound ID 381giRRa0ia
InChI InChI=1S/C11H18O3/c1-4-6-7-10(12)9(3)8-11(13)14-5-2/h8H,4-7H2,1-3H3/b9-8+
InChIKey SMJSRAAFPRUKML-CMDGGOBGSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kOGhFsCzZ7
Name (E)-Ethyl 3-methyl-4-oxooct-2-enoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-4-6-7-10(12)9(3)8-11(13)14-5-2/h8H,4-7H2,1-3H3/b9-8+
InChIKey SMJSRAAFPRUKML-CMDGGOBGSA-N
Literature Reference DOI 10.1002/cctc.201801040
Molecular Weight 198.262 g/mol
SMILES C(C)OC(\C=C\(C(CCCC)=O)C)=O
SPLASH splash10-03g3-3900000000-222e225f281750f21540
Source of Spectrum CCC-10-SM14-(E)_2c
Synonyms Ethyl (E)-3-methyl-4-oxooct-2-enoate
Wiley ID 1812733