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Specification
The molecular formula is C13H14N2.
The molecular weight is 198.26 g/mol.
The IUPAC name is 1-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine.
The InChI is InChI=1S/C13H14N2/c1-2-5-11(6-3-1)13-12-7-4-9-15(12)10-8-14-13/h1-7,9,13-14H,8,10H2.
The InChIKey is OJWIBJCTTSRXTB-UHFFFAOYSA-N.
The canonical SMILES is C1CN2C=CC=C2C(N1)C3=CC=CC=C3.
The CAS number is 112758-89-1.
The EC number is 878-988-5.
The ChEMBL ID is CHEMBL1307121.
Yes, 1-Phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine is a canonicalized compound.
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