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Concept information

Preferred term

benquoine  

Type

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

Broader concept

charge

  • 0

formula

  • C14H20O2

inchi

  • InChI=1S/C14H20O2/c1-13-11-9-7-5-3-2-4-6-8-10-12-14(15)16-13/h3,5-6,8,10,12-13H,2,4,7,9,11H2,1H3/b5-3+,8-6+,12-10+/t13-/m0/s1

inchikey

  • SWGHGMVUPRMHSQ-HIGNJNIISA-N

mass

  • 220.312

monoisotopicmass

  • 220.14633

smiles

  • O=C1O[C@H](CCCC=CCCC=CC=C1)C

subset

  • 2_STAR

synonym EXACT

  • (3E,5E,9E,14S)-14-methyl-1-oxacyclotetradeca-3,5,9-trien-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201835

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