4-(4-Ethoxyphenyl)-4-oxobutanoic acid

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Systematic / IUPAC Name: 4-(4-Ethoxyphenyl)-4-oxobutanoic acid

ID: Reference4314

Other Names: 3-(4-Ethoxybenzoyl)propanoic acid;
3-(4-Ethoxybenzoyl)propionic acid;
4-(4-Ethoxyphenyl)-4-oxobutyric acid;
Benzenebutanoic acid, 4-ethoxy-γ-oxo-

Formula: C12H14O4

Spectral Data

4-(4-Ethoxyphenyl)-4-oxobutanoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/21/2016 12:09:39 PM
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Identificators

InChI InChI=1S/C12H14O4/c1-2-16-10-5-3-9(4-6-10)11(13)7-8-12(14)15/h3-6H,2,7-8H2,1H3,(H,14,15)
InChI Key HXMFVOXVXQBEEJ-UHFFFAOYSA-N
Canonical SMILES CCOC1=CC=C(C=C1)C(=O)CCC(=O)O
CAS 53623373
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Other Names 3-(4-Ethoxybenzoyl)propanoic acid;
3-(4-Ethoxybenzoyl)propionic acid;
4-(4-Ethoxyphenyl)-4-oxobutyric acid;
Benzenebutanoic acid, 4-ethoxy-γ-oxo-

In Other Databases

ChemSpider 633651
ChEMBL CHEMBL1742087
PubChem 725709