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Benzaldehyde, 4-bromo-, [2,3,6,7-tetrahydro-7-(2-hydroxyethyl)-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]hydrazone
SpectraBase Compound ID HaZ1hLixLgZ
InChI InChI=1S/C16H17BrN6O3/c1-21-13-12(14(25)22(2)16(21)26)23(7-8-24)15(19-13)20-18-9-10-3-5-11(17)6-4-10/h3-6,9,24H,7-8H2,1-2H3,(H,19,20)/b18-9+
InChIKey PGMVKXBEEMRMDF-GIJQJNRQSA-N
Mol Weight 421.26 g/mol
Molecular Formula C16H17BrN6O3
Exact Mass 420.054551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpEu4H42vvg
Name Benzaldehyde, 4-bromo-, [2,3,6,7-tetrahydro-7-(2-hydroxyethyl)-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]hydrazone
Alternate Name(s) 8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-1,3-dimethylpurine-2,6-dione 8-[(2E)-2-[(4-bromophenyl)methylene]hydrazino]-7-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione 8-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione
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Formula C16H17BrN6O3
InChI InChI=1S/C16H17BrN6O3/c1-21-13-12(14(25)22(2)16(21)26)23(7-8-24)15(19-13)20-18-9-10-3-5-11(17)6-4-10/h3-6,9,24H,7-8H2,1-2H3,(H,19,20)/b18-9+
InChIKey PGMVKXBEEMRMDF-GIJQJNRQSA-N
Molecular Weight 421.255 g/mol
SMILES OCC[n]1c2C(N(C(N(c2nc1N\N=C\c1ccc(cc1)Br)C)=O)C)=O
SPLASH splash10-008c-9310100000-d78051ff29c600ede33d
Source of Spectrum IY-1-4684-8
Wiley ID 1654831