4-(1,1-Dimethylethyl)-β-oxobenzenepropanenitrile
CAS Registry Number®
39528-62-6
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CAS Name
4-(1,1-Dimethylethyl)-β-oxobenzenepropanenitrileMolecular Formula
C13H15NOMolecular Mass
201.26Cite this Page
4-(1,1-Dimethylethyl)-β-oxobenzenepropanenitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=39528-62-6 (retrieved ) (CAS RN: 39528-62-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H15NO/c1-13(2,3)11-6-4-10(5-7-11)12(15)8-9-14/h4-7H,8H2,1-3H3
InChIKey
InChIKey=LKZFEKFWLCDIBF-UHFFFAOYSA-N
SMILES
C(CC#N)(=O)C1=CC=C(C(C)(C)C)C=C1
Canonical SMILES
N#CCC(=O)C1=CC=C(C=C1)C(C)(C)C
Other Names for this Substance
- Benzenepropanenitrile, 4-(1,1-dimethylethyl)-β-oxo-
- 4-(1,1-Dimethylethyl)-β-oxobenzenepropanenitrile
- (p-tert-Butylbenzoyl)acetonitrile
- 3-(4-tert-Butylphenyl)-3-oxopropanenitrile
- 4-tert-Butylbenzoylacetonitrile