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2-Amino-6-methoxy-9-(pentafluorobenzyl)purine
SpectraBase Compound ID 5zq9AgBqZNi
InChI InChI=1S/C13H8F5N5O/c1-24-12-10-11(21-13(19)22-12)23(3-20-10)2-4-5(14)7(16)9(18)8(17)6(4)15/h3H,2H2,1H3,(H2,19,21,22)
InChIKey DFFOTNDATFMNAB-UHFFFAOYSA-N
Mol Weight 345.23 g/mol
Molecular Formula C13H8F5N5O
Exact Mass 345.064901 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vsZBg71G4c
Name 2-Amino-6-methoxy-9-(pentafluorobenzyl)purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F5N5O
InChI InChI=1S/C13H8F5N5O/c1-24-12-10-11(21-13(19)22-12)23(3-20-10)2-4-5(14)7(16)9(18)8(17)6(4)15/h3H,2H2,1H3,(H2,19,21,22)
InChIKey DFFOTNDATFMNAB-UHFFFAOYSA-N
Molecular Weight 345.233 g/mol
SMILES Nc1nc(c2c([n](Cc3c(c(c(F)c(c3F)F)F)F)cn2)n1)OC
SPLASH splash10-01pk-4908000000-1bc5b449a14528e09118
Source of Spectrum KO-18-967-11
Wiley ID 1338475