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Pyrimidin-4(3H)-one, 6-methyl-2-methylthio-3-(4-nitrobenzylidenamino)-
SpectraBase Compound ID LcgRgRWghLd
InChI InChI=1S/C13H12N4O3S/c1-9-7-12(18)16(13(15-9)21-2)14-8-10-3-5-11(6-4-10)17(19)20/h3-8H,1-2H3/b14-8+
InChIKey JKYWEAGNJAPDDA-RIYZIHGNSA-N
Mol Weight 304.32 g/mol
Molecular Formula C13H12N4O3S
Exact Mass 304.063011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cy2yBExKxy
Name Pyrimidin-4(3H)-one, 6-methyl-2-methylthio-3-(4-nitrobenzylidenamino)-
Alternate Name(s) 6-Methyl-2-(methylthio)-3-[(E)-(4-nitrobenzylidene)amino]pyrimidin-4-one 6-Methyl-2-(methylthio)-3-[(E)-(4-nitrophenyl)methylideneamino]-4-pyrimidinone 6-Methyl-2-methylsulfanyl-3-[(E)-(4-nitrophenyl)methyleneamino]pyrimidin-4-one 6-Methyl-2-methylsulfanyl-3-[(E)-(4-nitrophenyl)methylideneamino]pyrimidin-4-one
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Formula C13H12N4O3S
InChI InChI=1S/C13H12N4O3S/c1-9-7-12(18)16(13(15-9)21-2)14-8-10-3-5-11(6-4-10)17(19)20/h3-8H,1-2H3/b14-8+
InChIKey JKYWEAGNJAPDDA-RIYZIHGNSA-N
Molecular Weight 304.324 g/mol
SMILES CSC=1N(C(C=C(C)N1)=O)\N=C\c1ccc(N(=O)=O)cc1
SPLASH splash10-0a4i-8900000000-a49254c713ee1f658656
Source of Spectrum AD-0-2532-0
Wiley ID 1425901