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Substance Name: 2-(4'-Isobutylphenyl)propionitrile
RN: 99148-34-2
InChIKey: GSHMPFMOPDUCCK-UHFFFAOYSA-N

Molecular Formula

  • C13-H17-N

Molecular Weight

  • 187.284
 
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Names and Synonyms

Name of Substance

  • 2-(4'-Isobutylphenyl)propionitrile

Synonym

  • Ibu-CN

Systematic Name

  • Benzeneacetonitrile, alpha-methyl-4-(2-methylpropyl)-, (+-)-

Registry Numbers

CAS Registry Number

  • 99148-34-2

System Generated Number

  • 0099148342

Structure Descriptors

InChI

1S/C13H17N/c1-4-10(2)12-5-7-13(8-6-12)11(3)9-14/h5-8,10-11H,4H2,1-3H3

InChIKey

GSHMPFMOPDUCCK-UHFFFAOYSA-N

Smiles

c1cc([C@@H](C)CC)ccc1[C@@H](C)C#N