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(E)-Methyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)benzoate
SpectraBase Compound ID 70X9gPhNX7j
InChI InChI=1S/C13H14O4/c1-3-17-12(14)9-8-10-6-4-5-7-11(10)13(15)16-2/h4-9H,3H2,1-2H3/b9-8+
InChIKey IMHDUIYLJIZCGH-CMDGGOBGSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LTc4I35ub7
Name (E)-Methyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-3-17-12(14)9-8-10-6-4-5-7-11(10)13(15)16-2/h4-9H,3H2,1-2H3/b9-8+
InChIKey IMHDUIYLJIZCGH-CMDGGOBGSA-N
Molecular Weight 234.251 g/mol
SMILES C(c1c(\C=C\C(=O)OCC)cccc1)(=O)OC
SPLASH splash10-03di-0900000000-1bf6d682b58f7c77987f
Source of Spectrum F-68-1471-4ub
Synonyms 2-[(E)-3-ethoxy-3-oxoprop-1-enyl]benzoic acid methyl ester Methyl 2-[(E)-3-ethoxy-3-oxoprop-1-enyl]benzoate Methyl 2-[(E)-3-ethoxy-3-oxo-prop-1-enyl]benzoate Methyl 2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]benzoate
Wiley ID 1707702