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Strategies to access the [5-8] bicyclic core encountered in the sesquiterpene, diterpene and sesterterpene series

Cécile Alleman, Charlène Gadais, Laurent Legentil and François-Hugues Porée

Beilstein J. Org. Chem. 2023, 19, 245–281. https://doi.org/10.3762/bjoc.19.23

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Chemical structure C<sub>6</sub>H<sub>8</sub>O

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Extracted from

Scheme 2 Scheme 18

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₆H₈O
Molecular Weight	96.13 g/mol
Exact Mass	96.0575 Da
InChI	InChI=1S/C6H8O/c1-5-3-2-4-6(5)7/h3H,2,4H2,1H3
InChIKey	ZSBWUNDRDHVNJL-UHFFFAOYSA-N
SMILES	CC1=CCCC1=O
Number of Atoms	15
Number of H-Bond Acceptors	1
Number of H-Bond Donors	0
Atoms in the Largest π-System	4
XLogP	0.4

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