2-tert-Butylphenol

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Systematic / IUPAC Name: 2-(2-Methyl-2-propanyl)phenol

ID: Reference1449

Other Names: Phenol, 2-(1,1-dimethylethyl)-;
Phenol, o-tert-butyl-;
o-tert-Butylphenol;
Phenol, o-(tert-butyl)-;
2-(1,1-Dimethylethyl)phenol ; more

Formula: C10H14O

Class: Industrial Chemicals

Spectral Data

2-tert-Butylphenol 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 12/3/2014 12:53:01 PM
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Identificators

InChI InChI=1S/C10H14O/c1-10(2,3)8-6-4-5-7-9(8)11/h4-7,11H,1-3H3
InChI Key WJQOZHYUIDYNHM-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)C1=CC=CC=C1O
CAS 88186
Splash
Other Names Phenol, 2-(1,1-dimethylethyl)-;
Phenol, o-tert-butyl-;
o-tert-Butylphenol;
Phenol, o-(tert-butyl)-;
2-(1,1-Dimethylethyl)phenol;
2-tert-Butyl-1-hydroxybenzene;
Benzene, 1-tert-butyl-2-hydroxy-

In Other Databases

ChemSpider 6657
PubChem 6923
ChemIDPlus 000088186; 027178343; 041769066; 039068230
KEGG C14130
ChEMBL CHEMBL108851