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5-((2-Amino-5-(p-tolyl)-1H-imidazol-4-yl)(4-bromophenyl)methyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 1Yv3sqWGkr
InChI InChI=1S/C23H22BrN5O3/c1-12-4-6-14(7-5-12)18-19(27-22(25)26-18)16(13-8-10-15(24)11-9-13)17-20(30)28(2)23(32)29(3)21(17)31/h4-11,16,30H,1-3H3,(H3,25,26,27)
InChIKey GTQDYDFHGQGZNE-UHFFFAOYSA-N
Mol Weight 496.37 g/mol
Molecular Formula C23H22BrN5O3
Exact Mass 495.090603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WibnFotZQj
Name 5-((2-Amino-5-(p-tolyl)-1H-imidazol-4-yl)(4-bromophenyl)methyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22BrN5O3
InChI InChI=1S/C23H22BrN5O3/c1-12-4-6-14(7-5-12)18-19(27-22(25)26-18)16(13-8-10-15(24)11-9-13)17-20(30)28(2)23(32)29(3)21(17)31/h4-11,16,30H,1-3H3,(H3,25,26,27)
InChIKey GTQDYDFHGQGZNE-UHFFFAOYSA-N
Instrument Name Varian 1200L
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0014.306
Molecular Weight 496.365 g/mol
SMILES OC1=C(C(c2nc([nH]c2-c2ccc(C)cc2)N)c2ccc(Br)cc2)C(N(C(N1C)=O)C)=O
SPLASH splash10-05fu-0927000000-64446b828a07c60486f8
Source of Spectrum ARK-2013-75-12d
Wiley ID 1853465