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9-(2-fluoranyl-3-phenylmethoxy-propyl)purin-6-amine
SpectraBase Compound ID 4P85oo5DBIP
InChI InChI=1S/C15H16FN5O/c16-12(8-22-7-11-4-2-1-3-5-11)6-21-10-20-13-14(17)18-9-19-15(13)21/h1-5,9-10,12H,6-8H2,(H2,17,18,19)
InChIKey NNHGFPBRFBKILI-UHFFFAOYSA-N
Mol Weight 301.33 g/mol
Molecular Formula C15H16FN5O
Exact Mass 301.133888 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 412aKvW3eq
Name 9-(2-fluoranyl-3-phenylmethoxy-propyl)purin-6-amine
Alternate Name(s) 9-(2-fluoro-3-phenylmethoxypropyl)-6-purinamine 9-(2-fluoro-3-phenylmethoxypropyl)purin-6-amine 9-(3-benzyloxy-2-fluoro-propyl)purin-6-amine [9-(3-benzoxy-2-fluoro-propyl)purin-6-yl]amine
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Formula C15H16FN5O
InChI InChI=1S/C15H16FN5O/c16-12(8-22-7-11-4-2-1-3-5-11)6-21-10-20-13-14(17)18-9-19-15(13)21/h1-5,9-10,12H,6-8H2,(H2,17,18,19)
InChIKey NNHGFPBRFBKILI-UHFFFAOYSA-N
Molecular Weight 301.325 g/mol
SMILES Nc1c2c([n](cn2)CC(F)COCc2ccccc2)ncn1
SPLASH splash10-0005-9810000000-20feb3c87f13709553f3
Source of Spectrum G-57-1478-0
Wiley ID 813230