Chem
J-GLOBAL ID:200907064744227427   Nikkaji number:J2.047.954J

(2E,4E)-5-[1β,5,5-Trimethyl-3β-hydroxy-7-oxabicyclo[4.1.0]heptane-6β-yl]-3-methyl-2,4-pentadienenitrile

(2E,4E)-5-[1β,5,5-トリメチル-3β-ヒドロキシ-7-オキサビシクロ[4.1.0]ヘプタン-6β-イル]-3-メチル-2,4-ペンタジエンニトリル
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: C15H21NO2
Molecular formula furigana: C15-H21-N-O2
Molecular weight: 247.338
InChI: InChI=1S/C15H21NO2/c1-11(6-8-16)5-7-15-13(2,3)9-12(17)10-14(15,4)18-15/h5-7,12,17H,9-10H2,1-4H3/b7-5+,11-6+/t12-,14+,15-/m0/s1
InChI key: MSVWSVVBVZZNSR-LVMPZUNDSA-N
SMILES: C/C(=C\C#N)/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C
Systematic name  (4):
  • (2E,4E)-3-メチル-5-[(1S,4S,6R)-2,2,6-トリメチル-4-ヒドロキシ-7-オキサビシクロ[4.1.0]ヘプタン-1-イル]-2,4-ペンタジエンニトリル
  • (2E,4E)-5-[1β,5,5-トリメチル-3β-ヒドロキシ-7-オキサビシクロ[4.1.0]ヘプタン-6β-イル]-3-メチル-2,4-ペンタジエンニトリル
  • (2E,4E)-5-[(1S,4S,6R)-4-ヒドロキシ-2,2,6-トリメチル-7-オキサビシクロ[4.1.0]ヘプタン-1-イル]-3-メチルペンタ-2,4-ジエンニトリル
  • (2E,4E)-5-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3-methylpenta-2,4-dienenitrile
Other name (2):
  • (2E,4E)-3-Methyl-5-[(1S,4S,6R)-2,2,6-trimethyl-4-hydroxy-7-oxabicyclo[4.1.0]heptane-1-yl]-2,4-pentadienenitrile
  • (2E,4E)-5-[1β,5,5-Trimethyl-3β-hydroxy-7-oxabicyclo[4.1.0]heptane-6β-yl]-3-methyl-2,4-pentadienenitrile
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