Chem
J-GLOBAL ID：200907059111571400   Nikkaji number：J14.848B

β-Elemene

β-エレメン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C15H24
Molecular formula furigana： C15-H24
Molecular weight： 204.357
InChI： InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3/t13-,14+,15-/m1/s1
InChI key： OPFTUNCRGUEPRZ-QLFBSQMISA-N
SMILES： CC(=C)[C@@H]1CC[C@@](C)(C=C)[C@@H](C1)C(=C)C
Systematic name  (4)：
  • [1S,(-)]-1-メチル-2α,4α-ジイソプロペニル-1-ビニルシクロヘキサン
  • (1S,2S,4R)-1-メチル-1-ビニル-2,4-ジイソプロペニルシクロヘキサン
  • (1S,2S,4R)-1-エテニル-1-メチル-2,4-ビス(プロパ-1-エン-2-イル)シクロヘキサン
  • (1S,2S,4R)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane
Other name (12)：
  • (-)-β-エレメン
  • (-)-β-Elemene
  • beta-Elemen
  • levo-beta-エレメン
  • beta-エレメン
Show all
CAS registry number： 515-13-9
Regulation number (1)：
  • GU9660000
Application (1)：
smell substance
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