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Ethyl (E)-4-Oxo-4-phenyl-2-butenoate
SpectraBase Compound ID 1FxRkkWnATn
InChI InChI=1S/C12H12O3/c1-2-15-12(14)9-8-11(13)10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey ACXLBHHUHSJENU-CMDGGOBGSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDfRQz0Akos
Name Ethyl (E)-4-Oxo-4-phenyl-2-butenoate
CAS Registry Number 17450-56-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-2-15-12(14)9-8-11(13)10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey ACXLBHHUHSJENU-CMDGGOBGSA-N
Molecular Weight 204.225 g/mol
SMILES C(\C=C\C(=O)c1ccccc1)(=O)OCC
SPLASH splash10-0a4i-2900000000-680758b46250ae42296e
Source of Spectrum AT-40-3576-3
Synonyms (E)-4-keto-4-phenyl-but-2-enoic acid ethyl ester Ethyl 3-benzoylacrylate (E)-4-oxo-4-phenyl-2-butenoic acid ethyl ester Ethyl (E)-4-oxo-4-phenylbut-2-enoate Ethyl (2E)-4-oxo-4-phenyl-2-butenoate Ethyl (E)-4-oxidanylidene-4-phenyl-but-2-enoate Ethyl (E)-4-oxo-4-phenyl-but-2-enoate
Wiley ID 854449