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2-Benzyl-3-oxopropanoic acid, ethyl ester
SpectraBase Compound ID A6UxZEdDAvG
InChI InChI=1S/C12H14O3/c1-2-15-12(14)11(9-13)8-10-6-4-3-5-7-10/h3-7,9,11H,2,8H2,1H3
InChIKey QHBTZSFSMHRNCB-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMDqFw3E6Vc
Name 2-Benzyl-3-oxopropanoic acid, ethyl ester
Alternate Name(s) 2-Benzyl-3-keto-propionic acid ethyl ester 2-formyl-3-phenylpropanoic acid ethyl ester Ethyl 2-benzyl-3-oxo-propanoate Ethyl 2-methanoyl-3-phenyl-propanoate
CAS Registry Number 2016-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-2-15-12(14)11(9-13)8-10-6-4-3-5-7-10/h3-7,9,11H,2,8H2,1H3
InChIKey QHBTZSFSMHRNCB-UHFFFAOYSA-N
Molecular Weight 206.241 g/mol
SMILES C(=O)C(C(=O)OCC)Cc1ccccc1
SPLASH splash10-003u-9600000000-0863ed9e931b39b6b951
Wiley ID 1479716