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N-[(benzo[b]thien-3-yl)methyl]-3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID AOxebbhip26
InChI InChI=1S/C20H14Cl2N2O2S/c1-11-17(19(24-26-11)18-14(21)6-4-7-15(18)22)20(25)23-9-12-10-27-16-8-3-2-5-13(12)16/h2-8,10H,9H2,1H3,(H,23,25)
InChIKey IVRLNBAORZOTOF-UHFFFAOYSA-N
Mol Weight 417.31 g/mol
Molecular Formula C20H14Cl2N2O2S
Exact Mass 416.015304 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 81ijVaVO22r
Name N-[(BENZO[b]THIEN-3-YL)METHYL]-3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14Cl2N2O2S
InChI InChI=1S/C20H14Cl2N2O2S/c1-11-17(19(24-26-11)18-14(21)6-4-7-15(18)22)20(25)23-9-12-10-27-16-8-3-2-5-13(12)16/h2-8,10H,9H2,1H3,(H,23,25)
InChIKey IVRLNBAORZOTOF-UHFFFAOYSA-N
Melting Point 173C
Molecular Weight 417.32
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4-ISOXAZOLECARBOXAMIDE, N-//BENZO/B/THIEN-3-YL/METHYL/-3-/2,6-DICHLOROPHENYL/-5-METHYL-,