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1,9-Dihydro-6-[2-(phenyl)ethyl]-2H-purin-2-one
SpectraBase Compound ID 8X0oV2ssVND
InChI InChI=1S/C13H12N4O/c18-13-16-10(11-12(17-13)15-8-14-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,14,15,16,17,18)
InChIKey VOAVCCUAWDDJBN-UHFFFAOYSA-N
Mol Weight 240.27 g/mol
Molecular Formula C13H12N4O
Exact Mass 240.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpFy9PciFbb
Name 1,9-Dihydro-6-[2-(phenyl)ethyl]-2H-purin-2-one
Alternate Name(s) 6-(2-phenylethyl)-1,9-dihydro-2H-purin-2-one 6-(2-phenylethyl)-1,7-dihydropurin-2-one
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Formula C13H12N4O
InChI InChI=1S/C13H12N4O/c18-13-16-10(11-12(17-13)15-8-14-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,14,15,16,17,18)
InChIKey VOAVCCUAWDDJBN-UHFFFAOYSA-N
Molecular Weight 240.266 g/mol
SMILES N1C2=NC(NC(=C2N=C1)CCc1ccccc1)=O
SPLASH splash10-0006-2290000000-cbb383d639ad982ae816
Source of Spectrum K-2001-1670-14
Wiley ID 1579338