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9-Benzyl-6-(3-bromophenyl)-9H-purine
SpectraBase Compound ID KMJvrkn7wUq
InChI InChI=1S/C18H13BrN4/c19-15-8-4-7-14(9-15)16-17-18(21-11-20-16)23(12-22-17)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2
InChIKey VRFSIFSKOYPANG-UHFFFAOYSA-N
Mol Weight 365.23 g/mol
Molecular Formula C18H13BrN4
Exact Mass 364.032359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cfpes63bqwu
Name 9-Benzyl-6-(3-bromophenyl)-9H-purine
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.032359435 u
Formula C18H13BrN4
InChI InChI=1S/C18H13BrN4/c19-15-8-4-7-14(9-15)16-17-18(21-11-20-16)23(12-22-17)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2
InChIKey VRFSIFSKOYPANG-UHFFFAOYSA-N
Instrument Name JEOL AccuTof
Ionization Type EI
Literature Reference DOI 10.1002/anie.201609014
Molecular Weight 365.234 g/mol
Quality 208
Reported Formula C18H13(79)BrN4
SMILES C1(=CC=CC=C1)CN1C=NC=2C1=NC=NC2C1=CC(=CC=C1)Br
SPLASH splash10-0a4l-6094000000-3d1da71eabfdeb3a2969
Source of Spectrum ACI-56-SM11-2e (DOI: 10.1002/anie.201609014)
Wiley ID 1892846