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1,3,5-Tris(3-chloro-phenyl)-1,3,5-triazine-2,4,6-trione

View entire compound with spectra: 1 NMR, 3 FTIR, and 2 MS (GC)

1,3,5-Tris(3-chloro-phenyl)-1,3,5-triazine-2,4,6-trione
SpectraBase Compound ID LOq56jBkttb
InChI InChI=1S/C21H12Cl3N3O3/c22-13-4-1-7-16(10-13)25-19(28)26(17-8-2-5-14(23)11-17)21(30)27(20(25)29)18-9-3-6-15(24)12-18/h1-12H
InChIKey ZDLMPKONFSRTAQ-UHFFFAOYSA-N
Mol Weight 460.7 g/mol
Molecular Formula C21H12Cl3N3O3
Exact Mass 458.994424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJSCMiuOZMT
Name 1,3,5-tris(3-chlorophenyl)-1,3,5-triazinane-2,4,6-trione
Alternate Name(s) 1,3,5-tris(3-chlorophenyl)isocyanuric acid
CAS Registry Number 3420-84-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12Cl3N3O3
InChI InChI=1S/C21H12Cl3N3O3/c22-13-4-1-7-16(10-13)25-19(28)26(17-8-2-5-14(23)11-17)21(30)27(20(25)29)18-9-3-6-15(24)12-18/h1-12H
InChIKey ZDLMPKONFSRTAQ-UHFFFAOYSA-N
Molecular Weight 460.704 g/mol
SMILES C1(N(C(N(C(N1c1cc(Cl)ccc1)=O)c1cc(Cl)ccc1)=O)c1cc(Cl)ccc1)=O
SPLASH splash10-0udi-6900100000-51fc89d741fc926f2862
Wiley ID 1471866