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(Q82376681)
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English
{1-[(4-Methylphenyl)sulfanyl]cyclobutyl}(phenyl)methanone
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
282.107836196
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₈OS
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canonical SMILES
CC1=CC=C(C=C1)SC2(CCC2)C(=O)C3=CC=CC=C3
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Identifiers
InChI
InChI=1S/C18H18OS/c1-14-8-10-16(11-9-14)20-18(12-5-13-18)17(19)15-6-3-2-4-7-15/h2-4,6-11H,5,12-13H2,1H3
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InChIKey
DJYKFYZWMBXEMY-UHFFFAOYSA-N
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CAS Registry Number
84613-10-5
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PubChem CID
13029215
1 reference
matched by identifier from
InChIKey
InChIKey
DJYKFYZWMBXEMY-UHFFFAOYSA-N
UniChem compound ID
42998120
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30515677
1 reference
matched by identifier from
InChIKey
InChIKey
DJYKFYZWMBXEMY-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40466484
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