2,6-Di-tert-butyl-1,4-benzoquinone

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Systematic / IUPAC Name: 2,6-Bis(2-methyl-2-propanyl)-1,4-benzoquinone

ID: Reference607

Other Names: 2,6-Di-tert-butyl-p-benzoquinone;
p-Benzoquinone, 2,6-di-tert-butyl-;
2,5-Cyclohexadiene-1,4-dione, 2,6-bis(1,1-dimethylethyl)-;
2,6-Di-tert-butylbenzo-1,4-quinone;
2,6-Bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione

Formula: C14H20O2

Class: Endogenous Metabolites

Spectral Data

2,6-Di-tert-butyl-1,4-benzoquinone 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 2/11/2015 3:09:43 PM
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Identificators

InChI InChI=1S/C14H20O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8H,1-6H3
InChI Key RDQSIADLBQFVMY-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
CAS 719222
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Other Names 2,6-Di-tert-butyl-p-benzoquinone;
p-Benzoquinone, 2,6-di-tert-butyl-;
2,5-Cyclohexadiene-1,4-dione, 2,6-bis(1,1-dimethylethyl)-;
2,6-Di-tert-butylbenzo-1,4-quinone;
2,6-Bis(1,1-dimethylethyl)-2,5-cyclohexadiene-1,4-dione;
2,5-Cyclohexadien-1,4-dione, 2,6-bis(1,1-dimethylethyl)-

In Other Databases

PubChem 12867
ChemSpider 12336
ChemIDPlus 000719222
HMDb HMDB13817