4-Ethylphenol

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Systematic / IUPAC Name: 4-Ethylphenol

ID: Reference232

Other Names: p-Ethylphenol;
Phenol, 4-ethyl-;
Phenol, p-ethyl-;
1-Ethyl-4-hydroxybenzene;
1-Hydroxy-4-ethylbenzene ; more

Formula: C8H10O

Class: Endogenous Metabolites

Spectral Data

4-Ethylphenol 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 Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 146
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/26/2014 2:09:10 PM
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Identificators

InChI InChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3
InChI Key HXDOZKJGKXYMEW-UHFFFAOYSA-N
Canonical SMILES CCC1=CC=C(C=C1)O
CAS 123079
Splash
Other Names p-Ethylphenol;
Phenol, 4-ethyl-;
Phenol, p-ethyl-;
1-Ethyl-4-hydroxybenzene;
1-Hydroxy-4-ethylbenzene;
4-Hydroxyphenylethane;
4-Hydroxyethylbenzene;
Hydroxyphenylethane, p-;
Benzene, 1-ethyl, 4-hydroxy

In Other Databases

Wikipedia 4-Ethylphenol
ChEBI CHEBI:49584
ChemIDPlus 000123079; 024979702; 019277919; 029471883
PubChem 31242
KEGG C13637
ChEMBL CHEMBL108475
ChemSpider 28982
HMDb HMDB29306