(Q82746230)

English

(1S)-6,6-Dimethylbicyclo[3.1.1]hept-2-ene

group of stereoisomers with the chemical formula C₉H₁₄

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Statements

group of stereoisomers

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chemical compound

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122.109550448 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₉H₁₄

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based on heuristic

inferred from SMILES

canonical SMILES

CC1(C)C2C=CCC1C2

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC1(C)C2CC=C[C@@H]1C2

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C9H14/c1-9(2)7-4-3-5-8(9)6-7/h3-4,7-8H,5-6H2,1-2H3/t7-,8?/m1/s1

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SUEFRHDDZDWKFN-GVHYBUMESA-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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