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1H-Purin-6-amine, [(4-bromophenyl)methyl]-
SpectraBase Compound ID Kl0WQvI9C2M
InChI InChI=1S/C12H10BrN5/c13-8-3-1-7(2-4-8)5-9-17-10-11(14)15-6-16-12(10)18-9/h1-4,6H,5H2,(H3,14,15,16,17,18)
InChIKey DTMIGHOWXQLPOT-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 4B7X5uecZBp
Name 1H-Purin-6-amine, [(4-bromophenyl)methyl]-
Alternate Name(s) 8-(4-bromobenzyl)-1H-purin-6-amine 8-(4-bromobenzyl)-1H-purin-6-ylamine
CAS Registry Number 74421-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10BrN5
InChI InChI=1S/C12H10BrN5/c13-8-3-1-7(2-4-8)5-9-17-10-11(14)15-6-16-12(10)18-9/h1-4,6H,5H2,(H3,14,15,16,17,18)
InChIKey DTMIGHOWXQLPOT-UHFFFAOYSA-N
Molecular Weight 304.151 g/mol
SMILES N1C=NC=2C(=C1N)N=C(N2)Cc1ccc(cc1)Br
SPLASH splash10-004l-9200000000-b986f206456131c67e51
Source of Spectrum W6-27333-0-0
Wiley ID 45053