(Q82985130)

English

(3R,4S,6S)-4,9-dibromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undecan-3-ol

group of stereoisomers with the chemical formula C₁₅H₂₃Br₂ClO

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Statements

group of stereoisomers

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411.980417236 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₃Br₂ClO

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canonical SMILES

ClC1CC2(C(=C)CC(O)C(Br)C2(C)C)CCC1(Br)C

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isomeric SMILES

C=C1C[C@@H](O)[C@@H](Br)C(C)(C)[C@]12CCC(C)(Br)C(Cl)C2

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Identifiers

InChI=1S/C15H23Br2ClO/c1-9-7-10(19)12(16)13(2,3)15(9)6-5-14(4,17)11(18)8-15/h10-12,19H,1,5-8H2,2-4H3/t10-,11?,12-,14?,15+/m1/s1

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JPQFUHCOKXIWBB-LJURCNODSA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

DTXCID501421296

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