(Q105291771)

English

(1S,4S,6S,7S)-4-bromo-6-chloro-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decane

group of stereoisomers with the chemical formula C₁₅H₂₀BrClO₂

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Statements

group of stereoisomers

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chemical compound

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346.03351965999997 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₅H₂₀BrClO₂

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canonical SMILES

ClC1CC(Br)C(OC2CC1OC2CC=CC#C)CC

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isomeric SMILES

C#CC=CCC1O[C@H]2C[C@@H]1OC(CC)[C@@H](Br)C[C@@H]2Cl

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Identifiers

InChI=1S/C15H20BrClO2/c1-3-5-6-7-13-15-9-14(19-13)11(17)8-10(16)12(4-2)18-15/h1,5-6,10-15H,4,7-9H2,2H3/t10-,11-,12?,13?,14-,15-/m0/s1

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VRGYZGMXCGNRKB-DASPIEIJSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

VRGYZGMXCGNRKB-DASPIEIJSA-N

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