(Q82471603)

English

(3S,4S)-1-(Methanesulfinyl)-3,4-dimethyl-1-(methylsulfanyl)cyclopentane

group of stereoisomers with the chemical formula C₉H₁₈OS₂

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Statements

group of stereoisomers

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chemical compound

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206.079907196 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₉H₁₈OS₂

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based on heuristic

inferred from SMILES

canonical SMILES

CSC1(S(C)=O)CC(C)C(C)C1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CSC1(S(C)=O)C[C@H](C)[C@@H](C)C1

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C9H18OS2/c1-7-5-9(11-3,12(4)10)6-8(7)2/h7-8H,5-6H2,1-4H3/t7-,8-,12?/m0/s1

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ZJHSCENKGUGQTI-KNTUYYKSSA-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

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