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2,7-Diamino-5-(4-bromophenyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carbonitrile
SpectraBase Compound ID xdc0hcGNJY
InChI InChI=1S/C14H11BrN6O/c15-7-3-1-6(2-4-7)9-8(5-16)11(17)19-12-10(9)13(22)21-14(18)20-12/h1-4,9H,17H2,(H4,18,19,20,21,22)
InChIKey IJQKQIONHZSYFR-UHFFFAOYSA-N
Mol Weight 359.19 g/mol
Molecular Formula C14H11BrN6O
Exact Mass 358.017772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBud97c7Hkq
Name 2,7-Diamino-5-(4-bromophenyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11BrN6O
InChI InChI=1S/C14H11BrN6O/c15-7-3-1-6(2-4-7)9-8(5-16)11(17)19-12-10(9)13(22)21-14(18)20-12/h1-4,9H,17H2,(H4,18,19,20,21,22)
InChIKey IJQKQIONHZSYFR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/aoc.4043
Molecular Weight 359.187 g/mol
SMILES NC1=C(C(C2=C(N=C(NC2=O)N)N1)c1ccc(cc1)Br)C#N
SPLASH splash10-0ue9-2950000000-b932f1dd6a48c0098407
Source of Spectrum AOC-32-SM46-4e
Wiley ID 1812412