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9-(p-Fluorobenzyl)-6-chloro-9H-purine
SpectraBase Compound ID uXblPtDUG5
InChI InChI=1S/C12H8ClFN4/c13-11-10-12(16-6-15-11)18(7-17-10)5-8-1-3-9(14)4-2-8/h1-4,6-7H,5H2
InChIKey ZRTOPADHHJRWMN-UHFFFAOYSA-N
Mol Weight 262.68 g/mol
Molecular Formula C12H8ClFN4
Exact Mass 262.042152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKDUHgKUb1i
Name 9-(p-Fluorobenzyl)-6-chloro-9H-purine
Alternate Name(s) 6-Chloro-9-[(4-fluorophenyl)methyl]purine 6-Chloranyl-9-[(4-fluorophenyl)methyl]purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8ClFN4
InChI InChI=1S/C12H8ClFN4/c13-11-10-12(16-6-15-11)18(7-17-10)5-8-1-3-9(14)4-2-8/h1-4,6-7H,5H2
InChIKey ZRTOPADHHJRWMN-UHFFFAOYSA-N
Molecular Weight 262.675 g/mol
SMILES c12[n](cnc2c(Cl)ncn1)Cc1ccc(cc1)F
SPLASH splash10-08fr-2690000000-cf9a2676c3c3aa4f1283
Source of Spectrum AF-48-718-23
Wiley ID 1693847