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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > ketonitrile > beta-ketonitrile > 2-(4-fluorophenyl)-3-oxobutyronitrile
... > organooxygen compound > carbonyl compound > ketone > ketonitrile > beta-ketonitrile > 2-(4-fluorophenyl)-3-oxobutyronitrile

Preferred term

2-(4-fluorophenyl)-3-oxobutyronitrile  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C10H8FNO

has_functional_parent

inchi

  • InChI=1S/C10H8FNO/c1-7(13)10(6-12)8-2-4-9(11)5-3-8/h2-5,10H,1H3

inchikey

  • BASLPLDKFVWJLO-UHFFFAOYSA-N

mass

  • 177.17506

monoisotopicmass

  • 177.05899

smiles

  • CC(=O)C(C#N)c1ccc(F)cc1

subset

  • 3_STAR

synonym EXACT

  • 2-(4-fluorophenyl)-3-oxobutanenitrile

synonym RELATED

  • 2-(4-fluorophenyl)acetoacetonitrile

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:51858

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