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(Q82512651)
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English
1-(2,5-Dimethylphenyl)methanesulfonamide
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
199.2715
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₃NO₂S
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canonical SMILES
CC1=CC(=C(C=C1)C)CS(=O)(=O)N
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Identifiers
InChI
InChI=1S/C9H13NO2S/c1-7-3-4-8(2)9(5-7)6-13(10,11)12/h3-5H,6H2,1-2H3,(H2,10,11,12)
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InChIKey
CCCUCYFIXUXQDL-UHFFFAOYSA-N
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CAS Registry Number
919354-60-2
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PubChem CID
21323948
1 reference
matched by identifier from
InChIKey
InChIKey
CCCUCYFIXUXQDL-UHFFFAOYSA-N
UniChem compound ID
59698554
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20612427
1 reference
matched by identifier from
InChIKey
InChIKey
CCCUCYFIXUXQDL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20563182
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