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4-[(Z)-[1-(4-chlorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]benzoic acid
SpectraBase Compound ID 1ZcpQWkKIs5
InChI InChI=1S/C18H11ClN2O5/c19-12-5-7-13(8-6-12)21-16(23)14(15(22)20-18(21)26)9-10-1-3-11(4-2-10)17(24)25/h1-9H,(H,24,25)(H,20,22,26)/b14-9-
InChIKey UTAOZDCWJWIZMP-ZROIWOOFSA-N
Mol Weight 370.75 g/mol
Molecular Formula C18H11ClN2O5
Exact Mass 370.035649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzVR4zBPkmm
Name 4-[(Z)-[1-(4-chlorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]benzoic acid
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Formula C18H11ClN2O5
InChI InChI=1S/C18H11ClN2O5/c19-12-5-7-13(8-6-12)21-16(23)14(15(22)20-18(21)26)9-10-1-3-11(4-2-10)17(24)25/h1-9H,(H,24,25)(H,20,22,26)/b14-9-
InChIKey UTAOZDCWJWIZMP-ZROIWOOFSA-N
Molecular Weight 370.748 g/mol
SMILES OC(c1ccc(\C=C/2C(N(C(NC2=O)=O)c2ccc(cc2)Cl)=O)cc1)=O
SPLASH splash10-0uk9-1902000000-4bb76751f3635f47872b
Synonyms 4-[(Z)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]benzoic acid 4-[(Z)-[1-(4-chlorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]benzoic acid 4-[(Z)-[1-(4-chlorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]benzoic acid
Wiley ID 1452877