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(E)-Dimethyl 2-(3-methylbenzylidene) succinate
SpectraBase Compound ID 5uKcJCFYHBC
InChI InChI=1S/C14H16O4/c1-10-5-4-6-11(7-10)8-12(14(16)18-3)9-13(15)17-2/h4-8H,9H2,1-3H3/b12-8+
InChIKey ZHGKAYHIKQDMLL-XYOKQWHBSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpcK0ZcPyxn
Name (E)-Dimethyl 2-(3-methylbenzylidene) succinate
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.104858991 u
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-10-5-4-6-11(7-10)8-12(14(16)18-3)9-13(15)17-2/h4-8H,9H2,1-3H3/b12-8+
InChIKey ZHGKAYHIKQDMLL-XYOKQWHBSA-N
Instrument Name Agilent 5975C inert XL
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503744
Molecular Weight 248.278 g/mol
Quality 350
Reported Formula C14H16O4
SMILES C=1(C=CC=C(\C=C\(C(=O)OC)CC(=O)OC)C1)C
SPLASH splash10-00or-0930000000-ffcbe4c400b7326a57b8
Source of Spectrum QE-22-SM9-3al (DOI: 10.1002/chem.201503744)
Thin-Layer Chromatography 0.47 (SiO2, CH/EtOAc, 2:1)
Wiley ID 1903598