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HIT100419180
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HIT100419180
  • HIT ID:HIT100419180
  • Cas No:23726-91-2
  • Common Name:β-Damascone
  • IUPAC:(2E)-1-(2,6,6-trimethylcyclohex-1-en-1-yl)but-2-en-1-one
    IUPAC:(2E)-1-(2,6,6-trimethylcyclohex-1-en-1-yl)but-2-en-1-one
  • InChIKey:BGTBFNDXYDYBEY-FNORWQNLSA-N
  • Molecular Formula:C13H20O
  • Molecular Weight:192.302
  • Hydrogen Bond Donor (HBD):0
  • Hydrogen Bond Acceptor (HBA):1
  • LogP:4.69
  • SMILES:C\C=C\C(=O)C1=C(C)CCCC1(C)C |c:5|
    SMILES:C\C=C\C(=O)C1=C(C)CCCC1(C)C |c:5|
  • β-Damascone are a series of closely related chemical compounds that are components of a variety of essential oils. The damascones belong to a family of chemicals known as rose ketones, which also includes damascenones and ionones. beta-Damascone is a contributor to the aroma of roses, despite its relatively low concentration, and is an important fragrance chemical used in perfumery.
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