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Pyridazine-3,6(1H,2H)-dione, 1-(4-chloro-3-nitrophenyl)-

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

Pyridazine-3,6(1H,2H)-dione, 1-(4-chloro-3-nitrophenyl)-
SpectraBase Compound ID GDfdsoJCGG9
InChI InChI=1S/C10H6ClN3O4/c11-7-2-1-6(5-8(7)14(17)18)13-10(16)4-3-9(15)12-13/h1-5H,(H,12,15)
InChIKey OIKIGHQEYCQIMQ-UHFFFAOYSA-N
Mol Weight 267.63 g/mol
Molecular Formula C10H6ClN3O4
Exact Mass 267.004683 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Kn6LEREDqo
Name Pyridazine-3,6(1H,2H)-dione, 1-(4-chloro-3-nitrophenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.004683381 u
Formula C10H6ClN3O4
InChI InChI=1S/C10H6ClN3O4/c11-7-2-1-6(5-8(7)14(17)18)13-10(16)4-3-9(15)12-13/h1-5H,(H,12,15)
InChIKey OIKIGHQEYCQIMQ-UHFFFAOYSA-N
SMILES C1=C(C(=CC(=C1)N1C(C=CC(N1)=O)=O)N(=O)=O)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932869