Raspberry ketone

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Systematic / IUPAC Name: 4-(4-Hydroxyphenyl)butan-2-one

ID: Reference13807

Other Names: 4-(4-Hydroxyphenyl)-2-butanone;
4-(4-Hydroxyphenyl)butan-2-one;
AA-4098

Formula: C10H12O2

Class: Endogenous Metabolites

Spectral Data

Raspberry ketone 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 1
No. of Spectra 160
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/27/2026 9:30:19 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3
InChI Key NJGBTKGETPDVIK-UHFFFAOYSA-N
Canonical SMILES CC(=O)CCc1ccc(O)cc1
CAS
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Other Names 4-(4-Hydroxyphenyl)-2-butanone;
4-(4-Hydroxyphenyl)butan-2-one;
AA-4098

In Other Databases

ChEMBL CHEMBL105912
HMDb HMDB33723
PubChem 21648; 21648
ChemSpider 20347
ChEBI CHEBI:68656
Wikipedia Raspberry ketone