Nootkatone

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For Research Use Only | Not For Clinical Use
CATAPS4674504
CAS4674-50-4
Structure
SynonymsNootkanone,(4R,4aS,6R)-4,4a,5,6,7,8-Hexahydro-4,4a-dimethyl-6-(1-methylethenyl)-2(3H)-naphthalenone
IUPAC Name(4R,4aS,6R)-6-isopropenyl-4,4a-dimethyl-3,4,5,6,7,8-hexahydronaphthalen-2-one
Molecular Weight218.33
Molecular FormulaC15H22O
Canonical SMILESC[C@@H]1CC(=O)C=C2CC[C@H](C[C@@]12C)C(=C)C
InChIInChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1
Accurate Mass218.1671
FormatNeat
SubcategoryInsecticides and metabolites
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