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Ethyl (2E)-5-Acetyl-4-(4-fluorophenyl)-2-methyl-6-oxohept-2-enoate
SpectraBase Compound ID 8Svj6NEqlL4
InChI InChI=1S/C18H21FO4/c1-5-23-18(22)11(2)10-16(17(12(3)20)13(4)21)14-6-8-15(19)9-7-14/h6-10,16-17H,5H2,1-4H3/b11-10+
InChIKey QYKHDHZTNAUUTI-ZHACJKMWSA-N
Mol Weight 320.36 g/mol
Molecular Formula C18H21FO4
Exact Mass 320.142387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCX5K6nPjvc
Name Ethyl (2E)-5-Acetyl-4-(4-fluorophenyl)-2-methyl-6-oxohept-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21FO4
InChI InChI=1S/C18H21FO4/c1-5-23-18(22)11(2)10-16(17(12(3)20)13(4)21)14-6-8-15(19)9-7-14/h6-10,16-17H,5H2,1-4H3/b11-10+
InChIKey QYKHDHZTNAUUTI-ZHACJKMWSA-N
Molecular Weight 320.360 g/mol
SMILES C(\C(=C\C(C(C(C)=O)C(=O)C)c1ccc(cc1)F)C)(=O)OCC
SPLASH splash10-0f79-0974000000-90574c34d6d3975547d4
Source of Spectrum U1-2012-2590-3ac
Synonyms (E)-5-acetyl-4-(4-fluorophenyl)-2-methyl-6-oxo-2-heptenoic acid ethyl ester Ethyl (E)-5-acetyl-4-(4-fluorophenyl)-2-methyl-6-oxohept-2-enoate Ethyl (E)-5-acetyl-4-(4-fluorophenyl)-2-methyl-6-oxo-hept-2-enoate Ethyl (E)-5-ethanoyl-4-(4-fluorophenyl)-2-methyl-6-oxidanylidene-hept-2-enoate
Wiley ID 1715340