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5,6-Dichloro-3-(4-chlorophenyl)-4,7-dioxo-N-phenyl-4,7-dihydro-1H-indazole-1-carbothioamide
SpectraBase Compound ID VkTHr2OWNG
InChI InChI=1S/C20H10Cl3N3O2S/c21-11-8-6-10(7-9-11)16-13-17(19(28)15(23)14(22)18(13)27)26(25-16)20(29)24-12-4-2-1-3-5-12/h1-9H,(H,24,29)
InChIKey PUZPFEOMLYXCEO-UHFFFAOYSA-N
Mol Weight 462.74 g/mol
Molecular Formula C20H10Cl3N3O2S
Exact Mass 460.955931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMITGJAVdnp
Name 5,6-Dichloro-3-(4-chlorophenyl)-4,7-dioxo-N-phenyl-4,7-dihydro-1H-indazole-1-carbothioamide
Appearance Brown crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H10Cl3N3O2S
InChI InChI=1S/C20H10Cl3N3O2S/c21-11-8-6-10(7-9-11)16-13-17(19(28)15(23)14(22)18(13)27)26(25-16)20(29)24-12-4-2-1-3-5-12/h1-9H,(H,24,29)
InChIKey PUZPFEOMLYXCEO-UHFFFAOYSA-N
Instrument Name Varian MAT 311
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.f26
Molecular Weight 462.738 g/mol
SMILES N(C([n]1c2C(C(=C(C(c2c(n1)-c1ccc(cc1)Cl)=O)Cl)Cl)=O)=S)c1ccccc1
SPLASH splash10-02br-6910300000-4573207a2cf59a71c49e
Source of Spectrum ARK-2007-274-11d
Wiley ID 1868956