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(Q82481182)
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English
1-{[4-(Aminomethyl)phenyl]methyl}pyrrolidin-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
204.2687
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆N₂O
0 references
canonical SMILES
C1CC(=O)N(C1)CC2=CC=C(C=C2)CN
0 references
Identifiers
InChI
InChI=1S/C12H16N2O/c13-8-10-3-5-11(6-4-10)9-14-7-1-2-12(14)15/h3-6H,1-2,7-9,13H2
0 references
InChIKey
GPTRFBASHRQLSQ-UHFFFAOYSA-N
0 references
CAS Registry Number
953752-30-2
0 references
PubChem CID
16787111
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
GPTRFBASHRQLSQ-UHFFFAOYSA-N
UniChem compound ID
24429327
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50588489
1 reference
matched by identifier from
InChIKey
InChIKey
GPTRFBASHRQLSQ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90539253
0 references
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