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(Q82706658)
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English
(2-Phenyl-1H-pyrrol-3-yl)propanedinitrile
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
207.079647288
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₉N₃
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canonical SMILES
C1=CC=C(C=C1)C2=C(C=CN2)C(C#N)C#N
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Identifiers
InChI
InChI=1S/C13H9N3/c14-8-11(9-15)12-6-7-16-13(12)10-4-2-1-3-5-10/h1-7,11,16H
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InChIKey
JWBMLGOBNXBQGK-UHFFFAOYSA-N
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CAS Registry Number
89730-99-4
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PubChem CID
71325876
1 reference
matched by identifier from
InChIKey
InChIKey
JWBMLGOBNXBQGK-UHFFFAOYSA-N
UniChem compound ID
43213168
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00755144
1 reference
matched by identifier from
InChIKey
InChIKey
JWBMLGOBNXBQGK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20705888
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