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5,6,7,8-Tetrachloro-2-(4-nitro-phenyl)-1,3-dioxo-perhydro-benzo-3,4-diazeto(1,2-A)-S-triazol

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5,6,7,8-Tetrachloro-2-(4-nitro-phenyl)-1,3-dioxo-perhydro-benzo-3,4-diazeto(1,2-A)-S-triazol
SpectraBase Compound ID 9EAZSiCLLHW
InChI InChI=1S/C14H10Cl4N4O4/c15-7-8(16)10(18)12-11(9(7)17)20-13(23)19(14(24)21(12)20)5-1-3-6(4-2-5)22(25)26/h1-4,7-12H
InChIKey IRUGOQLIKZQTDN-UHFFFAOYSA-N
Mol Weight 440.1 g/mol
Molecular Formula C14H10Cl4N4O4
Exact Mass 437.945616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CyZo9SyKuyv
Name 5,6,7,8-Tetrachloro-2-(4-nitro-phenyl)-1,3-dioxo-perhydro-benzo-3,4-diazeto(1,2-A)-S-triazol
CAS Registry Number 63376-34-1
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C14H10Cl4N4O4
InChI InChI=1S/C14H10Cl4N4O4/c15-7-8(16)10(18)12-11(9(7)17)20-13(23)19(14(24)21(12)20)5-1-3-6(4-2-5)22(25)26/h1-4,7-12H
InChIKey IRUGOQLIKZQTDN-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference H. Wamhoff, K. Wald, Chem. Ber. 110, 1699 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6