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3-(2,6-dichlorophenyl)-5-methyl-N-(2-methyl-m-dithian-5-yl)-4-isoxazolecarboxamide

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3-(2,6-dichlorophenyl)-5-methyl-N-(2-methyl-m-dithian-5-yl)-4-isoxazolecarboxamide
SpectraBase Compound ID DDAp7TComZm
InChI InChI=1S/C16H16Cl2N2O2S2/c1-8-13(16(21)19-10-6-23-9(2)24-7-10)15(20-22-8)14-11(17)4-3-5-12(14)18/h3-5,9-10H,6-7H2,1-2H3,(H,19,21)
InChIKey ZWSVUFLMWKPXNJ-UHFFFAOYSA-N
Mol Weight 403.34 g/mol
Molecular Formula C16H16Cl2N2O2S2
Exact Mass 402.003026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cuw0B6urt3e
Name 3-(2,6-Dichlorophenyl)-5-methyl-N-(2-methyl-m-dithian-5-yl)-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.003025509 u
Formula C16H16Cl2N2O2S2
InChI InChI=1S/C16H16Cl2N2O2S2/c1-8-13(16(21)19-10-6-23-9(2)24-7-10)15(20-22-8)14-11(17)4-3-5-12(14)18/h3-5,9-10H,6-7H2,1-2H3,(H,19,21)
InChIKey ZWSVUFLMWKPXNJ-UHFFFAOYSA-N
SMILES N(C1CSC(SC1)C)C(C=1C(=NOC1C)C=1C(=CC=CC1Cl)Cl)=O