Phenyl acetate

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Systematic / IUPAC Name: Phenyl acetate

ID: Reference13917

Other Names: AA-4543

Formula: C8H8O2

Class: Endogenous Metabolites

Spectral Data

Phenyl acetate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 2
No. of Spectra 440
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 5/22/2026 10:23:36 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3
InChI Key IPBVNPXQWQGGJP-UHFFFAOYSA-N
Canonical SMILES CC(=O)Oc1ccccc1
CAS
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Other Names AA-4543

In Other Databases

PubChem 31229; 31229
HMDb HMDB40733
KEGG C15583
ChEMBL CHEMBL289559
ChemSpider 28969
ChEBI CHEBI:8082
Wikipedia Phenyl acetate