(Q105148405)

English

[(1S,4S)-4-(4-bromo-3,3-dimethylcyclohexyl)-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl]methanol

group of stereoisomers with the chemical formula C₁₅H₂₃BrO₃

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Statements

group of stereoisomers

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chemical compound

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330.083056696 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₅H₂₃BrO₃

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canonical SMILES

BrC1CCC(CC1(C)C)C23OOC(C=C2)(CO)CC3

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isomeric SMILES

CC1(C)CC([C@]23C=C[C@](CO)(CC2)OO3)CCC1Br

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Identifiers

InChI=1S/C15H23BrO3/c1-13(2)9-11(3-4-12(13)16)15-7-5-14(10-17,6-8-15)18-19-15/h5,7,11-12,17H,3-4,6,8-10H2,1-2H3/t11?,12?,14-,15+/m1/s1

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KZRDDGGREUNDMV-VHMBPLKRSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KZRDDGGREUNDMV-VHMBPLKRSA-N

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