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5,5'-((1-(4-bromophenyl)ethane-1,1-diyl)bis(azaneylylidene))bis(6-amino-1-ethyldihydro-pyrimidine-2,4(1H,3H)-dione)
SpectraBase Compound ID Ir8pezCtEFj
InChI InChI=1S/C20H25BrN8O4/c1-4-28-14(22)12(16(30)24-18(28)32)26-20(3,10-6-8-11(21)9-7-10)27-13-15(23)29(5-2)19(33)25-17(13)31/h6-9,14-15H,4-5,22-23H2,1-3H3,(H,24,30,32)(H,25,31,33)
InChIKey JWCLVACAZMWOBK-UHFFFAOYSA-N
Mol Weight 521.38 g/mol
Molecular Formula C20H25BrN8O4
Exact Mass 520.118214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FA65b1aKAD
Name 5,5'-((1-(4-bromophenyl)ethane-1,1-diyl)bis(azaneylylidene))bis(6-amino-1-ethyldihydro-pyrimidine-2,4(1H,3H)-dione)
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Formula C20H25BrN8O4
InChI InChI=1S/C20H25BrN8O4/c1-4-28-14(22)12(16(30)24-18(28)32)26-20(3,10-6-8-11(21)9-7-10)27-13-15(23)29(5-2)19(33)25-17(13)31/h6-9,14-15H,4-5,22-23H2,1-3H3,(H,24,30,32)(H,25,31,33)
InChIKey JWCLVACAZMWOBK-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 5050A
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2021.103669
Molecular Weight 521.376 g/mol
SMILES N1C(N(C(C(=NC(N=C2C(N(C(NC2=O)=O)CC)N)(C)C2=CC=C(C=C2)Br)C1=O)N)CC)=O
SPLASH splash10-003j-4229520000-1b80c21af8cf09a7a493
Source of Spectrum AJC-15-15-11 (DOI: 10.1016/j.arabjc.2021.103669)
Wiley ID 1908043