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(+-)-2-(4'-isobutylphenyl)propionitrile

Properties

Image

Occurences in reactions

MNX_ID

MNXM30186

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₃H₁₇N

charge

mass

187.1361

reference

InChIKey

PKQKHWNHCKNYSW-UHFFFAOYSA-N

InChI

InChI=1S/C13H17N/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,10-11H,8H2,1-3H3

SMILES

CC(C)Cc1ccc(C(C)C#N)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27415 chebi:27415	(+-)-2-(4'-isobutylphenyl)propionitrile (+/-)-2-(4'-Isobutylphenyl)propionitrile 2-(4-Isobutylphenyl)propiononitrile 2-(4-isobutylphenyl)propanenitrile 2-(p-isobutylphenyl)propiononitrile
seed.compound:cpd02727 seedM:cpd02727 kegg.compound:C04469 keggC:C04469	(+/-)-2-(4'-Isobutylphenyl)propionitrile
chebi:18461 chebi:66 keggC:M_C04469 seedM:M_cpd02727	secondary/obsolete/fantasy identifier