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(Q82699714)
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English
[(2-Methyl-5-nitroquinolin-8-yl)oxy]acetonitrile
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
243.064391148
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₉N₃O₃
0 references
canonical SMILES
CC1=NC2=C(C=CC(=C2C=C1)[N+](=O)[O-])OCC#N
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Identifiers
InChI
InChI=1S/C12H9N3O3/c1-8-2-3-9-10(15(16)17)4-5-11(12(9)14-8)18-7-6-13/h2-5H,7H2,1H3
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InChIKey
LOKKMXKBZRDFML-UHFFFAOYSA-N
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CAS Registry Number
88757-93-1
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PubChem CID
71320045
1 reference
matched by identifier from
InChIKey
InChIKey
LOKKMXKBZRDFML-UHFFFAOYSA-N
UniChem compound ID
64860407
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90750027
1 reference
matched by identifier from
InChIKey
InChIKey
LOKKMXKBZRDFML-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60700771
0 references
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