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4-(4-Nitrophenyl)-6-phenyl-2-thioxo-2,3,4,6-tetrahydropyrimido[5,4-c]quinolin-5(1H)-one
SpectraBase Compound ID HzziiijesmE
InChI InChI=1S/C23H16N4O3S/c28-22-19-20(14-10-12-16(13-11-14)27(29)30)24-23(31)25-21(19)17-8-4-5-9-18(17)26(22)15-6-2-1-3-7-15/h1-13,20H,(H2,24,25,31)
InChIKey YPHKPXZMARIDIG-UHFFFAOYSA-N
Mol Weight 428.47 g/mol
Molecular Formula C23H16N4O3S
Exact Mass 428.094312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rVwZJYE5u6
Name 4-(4-Nitrophenyl)-6-phenyl-2-thioxo-2,3,4,6-tetrahydropyrimido[5,4-c]quinolin-5(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16N4O3S
InChI InChI=1S/C23H16N4O3S/c28-22-19-20(14-10-12-16(13-11-14)27(29)30)24-23(31)25-21(19)17-8-4-5-9-18(17)26(22)15-6-2-1-3-7-15/h1-13,20H,(H2,24,25,31)
InChIKey YPHKPXZMARIDIG-UHFFFAOYSA-N
Instrument Name Finigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2286
Molecular Weight 428.466 g/mol
SMILES N1C(NC(C2=C1c1ccccc1N(C2=O)c1ccccc1)c1ccc(cc1)[N+]([O-])=O)=S
SPLASH splash10-0a6r-0900400000-505f5db124eaa931f806
Source of Spectrum Y-53-386-7d
Wiley ID 1876334