2-[3-(2,6-Dimethylphenyl)-1-oxopropyl]benzonitrile
CAS Registry Number®
898754-40-0
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CAS Name
2-[3-(2,6-Dimethylphenyl)-1-oxopropyl]benzonitrileMolecular Formula
C18H17NOMolecular Mass
263.33Cite this Page
2-[3-(2,6-Dimethylphenyl)-1-oxopropyl]benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898754-40-0 (retrieved ) (CAS RN: 898754-40-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H17NO/c1-13-6-5-7-14(2)16(13)10-11-18(20)17-9-4-3-8-15(17)12-19/h3-9H,10-11H2,1-2H3
InChIKey
InChIKey=CYCAJOLVMFGIPH-UHFFFAOYSA-N
SMILES
C(CCC1=C(C)C=CC=C1C)(=O)C2=C(C#N)C=CC=C2
Canonical SMILES
N#CC=1C=CC=CC1C(=O)CCC=2C(=CC=CC2C)C
Other Names for this Substance
- Benzonitrile, 2-[3-(2,6-dimethylphenyl)-1-oxopropyl]-
- 2-[3-(2,6-Dimethylphenyl)-1-oxopropyl]benzonitrile