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(E)-Diethyl 2-(2-methylbenzylidene)succinate
SpectraBase Compound ID JMY9foVj6EM
InChI InChI=1S/C16H20O4/c1-4-19-15(17)11-14(16(18)20-5-2)10-13-9-7-6-8-12(13)3/h6-10H,4-5,11H2,1-3H3/b14-10+
InChIKey ZEHOPJZWXGOURX-GXDHUFHOSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHVSYCiwMic
Name (E)-Diethyl 2-(2-methylbenzylidene)succinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-4-19-15(17)11-14(16(18)20-5-2)10-13-9-7-6-8-12(13)3/h6-10H,4-5,11H2,1-3H3/b14-10+
InChIKey ZEHOPJZWXGOURX-GXDHUFHOSA-N
Literature Reference DOI 10.1021/acs.orglett.5b01352
Molecular Weight 276.332 g/mol
SMILES C(\C(CC(=O)OCC)=C\c1ccccc1C)(=O)OCC
SPLASH splash10-003r-0940000000-2047c02b19042f809093
Source of Spectrum A1-17-3078/SM3-3b
Synonyms Diethyl (E)-2-(2-methylbenzylidene)succinate
Wiley ID 1804932