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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>13</sub>H<sub>22</sub>O<sub>2</sub>

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Extracted from

Scheme 15

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₃H₂₂O₂
Molecular Weight	210.31 g/mol
Exact Mass	210.1620 Da
InChI	InChI=1S/C13H22O2/c1-8(2)12-10-6-9(14)4-5-13(10,3)7-11(12)15/h8,10-12,15H,4-7H2,1-3H3/t10-,11+,12+,13-/m1/s1
InChIKey	ZJTHUEKFROFQJT-MROQNXINSA-N
SMILES	CC(C)[C@H]1[C@@]2([H])CC(=O)CC[C@]2(C)C[C@@H]1O
Number of Atoms	37
Number of H-Bond Acceptors	2
Number of H-Bond Donors	1
Atoms in the Largest π-System	1
XLogP	2.3

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