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7-(p-Fluorobenzyl)-7H-purine

View entire compound with spectra: 1 MS (GC)

7-(p-Fluorobenzyl)-7H-purine
SpectraBase Compound ID 6ZjnGJPx6kY
InChI InChI=1S/C12H9FN4/c13-10-3-1-9(2-4-10)6-17-8-16-12-11(17)5-14-7-15-12/h1-5,7-8H,6H2
InChIKey HHFHQBHCANDNDB-UHFFFAOYSA-N
Mol Weight 228.23 g/mol
Molecular Formula C12H9FN4
Exact Mass 228.081124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Y91fK0VgW
Name 7-(p-Fluorobenzyl)-7H-purine
Alternate Name(s) 7-[(4-Fluorophenyl)methyl]purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9FN4
InChI InChI=1S/C12H9FN4/c13-10-3-1-9(2-4-10)6-17-8-16-12-11(17)5-14-7-15-12/h1-5,7-8H,6H2
InChIKey HHFHQBHCANDNDB-UHFFFAOYSA-N
Molecular Weight 228.230 g/mol
SMILES c12[n](cnc2ncnc1)Cc1ccc(cc1)F
SPLASH splash10-0a6r-3970000000-c00543519ff4340c1cf9
Source of Spectrum AF-48-718-20
Wiley ID 1693850