4-tert-Butylcyclohexyl acetate

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Systematic / IUPAC Name: 4-(2-Methyl-2-propanyl)cyclohexyl acetate

ID: Reference628

Other Names: p-tert-Butylcyclohexyl acetate;
4-tert-Butylcyclohexanol acetate;
4-tert-Butylhexahydrophenyl acetate;
Cyclohexanol, 4-(1,1-dimethylethyl)-, acetate;
Acetic acid, (4-tert-butylcyclohexyl) ester ; more

Formula: C12H22O2

Class: Industrial Chemicals

Spectral Data

4-tert-Butylcyclohexyl acetate 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 2/13/2015 11:03:14 AM
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Identificators

InChI InChI=1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3
InChI Key MBZRJSQZCBXRGK-UHFFFAOYSA-N
Canonical SMILES CC(=O)OC1CCC(CC1)C(C)(C)C
CAS 104052
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Other Names p-tert-Butylcyclohexyl acetate;
4-tert-Butylcyclohexanol acetate;
4-tert-Butylhexahydrophenyl acetate;
Cyclohexanol, 4-(1,1-dimethylethyl)-, acetate;
Acetic acid, (4-tert-butylcyclohexyl) ester;
Cyclohexanol, 4-tert-butyl-, acetate;
Cyclohexanol, 4-(1,1-dimethylethyl)-, 1-acetate;
Vertenex

In Other Databases

PubChem 36081
ChemIDPlus 032210234; 001900692; 010411924; 084930110
ChEMBL CHEMBL1887173
ChemSpider 33188