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(Q82421393)
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English
[(2,2,3,3-Tetramethylcyclopropyl)sulfanyl]benzene
chemical compound
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instance of
type of chemical entity
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subclass of
chemical compound
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mass
206.112921576
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₈S
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canonical SMILES
CC1(C(C1(C)C)SC2=CC=CC=C2)C
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Identifiers
InChI
InChI=1S/C13H18S/c1-12(2)11(13(12,3)4)14-10-8-6-5-7-9-10/h5-9,11H,1-4H3
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InChIKey
IHOCMMHWEWKLHX-UHFFFAOYSA-N
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CAS Registry Number
100045-89-4
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PubChem CID
13582003
1 reference
matched by identifier from
InChIKey
InChIKey
IHOCMMHWEWKLHX-UHFFFAOYSA-N
UniChem compound ID
50064671
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60544314
1 reference
matched by identifier from
InChIKey
InChIKey
IHOCMMHWEWKLHX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60495099
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