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Concept information

Preferred term

cyclohexa-1,5-diene-1-carboxylic acid  

Type

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

charge

  • 0

formula

  • C7H8O2

inchi

  • InChI=1S/C7H8O2/c8-7(9)6-4-2-1-3-5-6/h2,4-5H,1,3H2,(H,8,9)

inchikey

  • QXHJRNVPNQKMLR-UHFFFAOYSA-N

mass

  • 124.13722

monoisotopicmass

  • 124.05243

smiles

  • OC(=O)C1=CCCC=C1

subset

  • 3_STAR

synonym EXACT

  • cyclohexa-1,5-diene-1-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:49262

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