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(Q82399905)
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English
4,4'-(2-Oxopropane-1,3-diyl)dibenzonitrile
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
260.2906
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₂N₂O
0 references
canonical SMILES
C1=CC(=CC=C1CC(=O)CC2=CC=C(C=C2)C#N)C#N
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Identifiers
InChI
InChI=1S/C17H12N2O/c18-11-15-5-1-13(2-6-15)9-17(20)10-14-3-7-16(12-19)8-4-14/h1-8H,9-10H2
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InChIKey
DCQQHFAQUYATLP-UHFFFAOYSA-N
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CAS Registry Number
29903-10-4
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PubChem CID
13221704
1 reference
matched by identifier from
InChIKey
InChIKey
DCQQHFAQUYATLP-UHFFFAOYSA-N
UniChem compound ID
25188504
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00529468
1 reference
matched by identifier from
InChIKey
InChIKey
DCQQHFAQUYATLP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50480257
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