Ethyl benzoate

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Systematic / IUPAC Name: Ethyl benzoate

ID: Reference715

Other Names: Benzoic acid, ethyl ester;
Ethyl benzenecarboxylate;
Benzoyl ethyl ether;
Benzoic acid ethyl ester

Formula: C9H10O2

Class: Industrial Chemicals

Spectral Data

Ethyl benzoate 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 71
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/26/2015 3:08:00 PM
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Identificators

InChI InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChI Key MTZQAGJQAFMTAQ-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C1=CC=CC=C1
CAS 93890
Splash
Other Names Benzoic acid, ethyl ester;
Ethyl benzenecarboxylate;
Benzoyl ethyl ether;
Benzoic acid ethyl ester

In Other Databases

ChemIDPlus 000093890; 070750026; 070750037; 070750048
PubChem 7165
ChEMBL CHEMBL510714
ChemSpider 6897
Wikipedia Ethyl benzoate
HMDb HMDB33967