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(Q82837723)
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English
[2-(2-tert-Butylphenoxy)pyridin-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
291.3478
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₇N₃O
0 references
canonical SMILES
CC(C)(C)C1=CC=CC=C1OC2=C(C=CC=N2)C(C#N)C#N
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Identifiers
InChI
InChI=1S/C18H17N3O/c1-18(2,3)15-8-4-5-9-16(15)22-17-14(7-6-10-21-17)13(11-19)12-20/h4-10,13H,1-3H3
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InChIKey
FFUGOQMBGYSLRL-UHFFFAOYSA-N
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CAS Registry Number
918343-21-2
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PubChem CID
71427419
1 reference
matched by identifier from
InChIKey
InChIKey
FFUGOQMBGYSLRL-UHFFFAOYSA-N
UniChem compound ID
57343788
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70846159
1 reference
matched by identifier from
InChIKey
InChIKey
FFUGOQMBGYSLRL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50796901
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