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[7-(p-Fluorobenzyl)-7H-purin-6'-yl]-amine
SpectraBase Compound ID LPMRUdrp931
InChI InChI=1S/C12H10FN5/c13-9-3-1-8(2-4-9)5-18-7-17-12-10(18)11(14)15-6-16-12/h1-4,6-7H,5H2,(H2,14,15,16)
InChIKey CQLKWESHTUNFIE-UHFFFAOYSA-N
Mol Weight 243.25 g/mol
Molecular Formula C12H10FN5
Exact Mass 243.092024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2E8c2h0doTW
Name [7-(p-Fluorobenzyl)-7H-purin-6'-yl]-amine
Alternate Name(s) [9-(p-Fluorobenzyl)-9H-purin-6'-yl]-amine 7-[(4-fluorophenyl)methyl]-6-purinamine 7-[(4-fluorophenyl)methyl]purin-6-amine
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Formula C12H10FN5
InChI InChI=1S/C12H10FN5/c13-9-3-1-8(2-4-9)5-18-7-17-12-10(18)11(14)15-6-16-12/h1-4,6-7H,5H2,(H2,14,15,16)
InChIKey CQLKWESHTUNFIE-UHFFFAOYSA-N
Molecular Weight 243.245 g/mol
SMILES Nc1c2[n](cnc2ncn1)Cc1ccc(cc1)F
SPLASH splash10-0a4l-2970000000-8ab1db5066aad6708c57
Source of Spectrum AF-48-719-27
Wiley ID 1693843