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Concept information

Preferred term

3,5-heptanedione, 4-ethyl-2,2,6,6-tetramethyl-  

Type

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

Broader concept

charge

  • 0

formula

  • C13H24O2

inchi

  • InChI=1S/C13H24O2/c1-8-9(10(14)12(2,3)4)11(15)13(5,6)7/h9H,8H2,1-7H3

inchikey

  • JKEWQMMYIOHEBI-UHFFFAOYSA-N

mass

  • 212.333

monoisotopicmass

  • 212.17763

smiles

  • O=C(C(C(=O)C(C)(C)C)CC)C(C)(C)C

subset

  • 2_STAR

synonym EXACT

  • 4-ethyl-2,2,6,6-tetramethylheptane-3,5-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229371

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