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6-(2-Furyl)-9-[(p-chlorophenyl)methyl]-9H-purine
SpectraBase Compound ID L0MfDJ4h7pu
InChI InChI=1S/C16H11ClN4O/c17-12-5-3-11(4-6-12)8-21-10-20-15-14(13-2-1-7-22-13)18-9-19-16(15)21/h1-7,9-10H,8H2
InChIKey IKRFJTPPXGEQET-UHFFFAOYSA-N
Mol Weight 310.74 g/mol
Molecular Formula C16H11ClN4O
Exact Mass 310.062139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gx9mKyxOrVy
Name 6-(2-Furyl)-9-[(p-chlorophenyl)methyl]-9H-purine
Alternate Name(s) 9-[(4-chlorophenyl)methyl]-6-(2-furanyl)purine 9-[(4-chlorophenyl)methyl]-6-(2-furyl)purine 9-[(4-chlorophenyl)methyl]-6-(furan-2-yl)purine
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Formula C16H11ClN4O
InChI InChI=1S/C16H11ClN4O/c17-12-5-3-11(4-6-12)8-21-10-20-15-14(13-2-1-7-22-13)18-9-19-16(15)21/h1-7,9-10H,8H2
InChIKey IKRFJTPPXGEQET-UHFFFAOYSA-N
Molecular Weight 310.744 g/mol
SMILES c12c([n](Cc3ccc(cc3)Cl)cn1)ncnc2-c1occc1
SPLASH splash10-03fr-1609000000-f8608339e6b2a342e6df
Source of Spectrum AF-48-2718-7b
Wiley ID 1693889