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1H-Purin-6-amine, [(2-bromophenyl)methyl]-
SpectraBase Compound ID 8tq1Yl0H5Qg
InChI InChI=1S/C12H10BrN5/c13-8-4-2-1-3-7(8)5-9-17-10-11(14)15-6-16-12(10)18-9/h1-4,6H,5H2,(H3,14,15,16,17,18)
InChIKey KJRFATPTFMUWEE-UHFFFAOYSA-N
Mol Weight 304.15 g/mol
Molecular Formula C12H10BrN5
Exact Mass 303.011958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zfjNfnfsGd
Name 1H-Purin-6-amine, [(2-bromophenyl)methyl]-
Alternate Name(s) 8-(2-bromobenzyl)-1H-purin-6-amine 8-(2-bromobenzyl)-1H-purin-6-ylamine
CAS Registry Number 74421-49-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10BrN5
InChI InChI=1S/C12H10BrN5/c13-8-4-2-1-3-7(8)5-9-17-10-11(14)15-6-16-12(10)18-9/h1-4,6H,5H2,(H3,14,15,16,17,18)
InChIKey KJRFATPTFMUWEE-UHFFFAOYSA-N
Molecular Weight 304.151 g/mol
SMILES N1C=NC=2C(=C1N)N=C(N2)Cc1c(Br)cccc1
SPLASH splash10-00mo-9210000000-bd93148382b0454031d2
Source of Spectrum W5-27332-0-0
Wiley ID 1305388