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Concept information

Preferred term

3,5-bis(2-cyanopropan-2-yl)benzoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H16N2O2

inchi

  • InChI=1S/C15H16N2O2/c1-14(2,8-16)11-5-10(13(18)19)6-12(7-11)15(3,4)9-17/h5-7H,1-4H3,(H,18,19)

inchikey

  • VUATUXZRGNXRDW-UHFFFAOYSA-N

mass

  • 256.300

monoisotopicmass

  • 256.121

smiles

  • O=C(O)C1=CC(=CC(=C1)C(C#N)(C)C)C(C#N)(C)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143334

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