(Q82919036)

English

2,2,5a,9-Tetramethyloctahydro-2H-3,9a-methano-1-benzoxepine

group of stereoisomers with the chemical formula C₁₅H₂₆O

In more languages

Statements

group of stereoisomers

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chemical compound

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222.198365452 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₆O

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based on heuristic

inferred from SMILES

canonical SMILES

CC1CCCC2(C)CCC3CC12OC3(C)C

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C[C@H]1CCC[C@@]2(C)CC[C@@H]3CC12OC3(C)C

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C15H26O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h11-12H,5-10H2,1-4H3/t11-,12+,14-,15?/m0/s1

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HVAVUZLEYSAYGE-PEZGSVAQSA-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

DTXCID401370484

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