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acetamide, 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,6-dichlorophenyl)-
SpectraBase Compound ID 3PWOiX2mAmn
InChI InChI=1S/C27H19Cl2N3O2S/c1-34-19-12-10-17(11-13-19)20-14-24(18-6-3-2-4-7-18)31-27(21(20)15-30)35-16-25(33)32-26-22(28)8-5-9-23(26)29/h2-14H,16H2,1H3,(H,32,33)
InChIKey CBCIYNPPPBFOFN-UHFFFAOYSA-N
Mol Weight 520.43 g/mol
Molecular Formula C27H19Cl2N3O2S
Exact Mass 519.057503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JiEkAFJqsWA
Name acetamide, 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,6-dichlorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 519.057503436 u
Formula C27H19Cl2N3O2S
InChI InChI=1S/C27H19Cl2N3O2S/c1-34-19-12-10-17(11-13-19)20-14-24(18-6-3-2-4-7-18)31-27(21(20)15-30)35-16-25(33)32-26-22(28)8-5-9-23(26)29/h2-14H,16H2,1H3,(H,32,33)
InChIKey CBCIYNPPPBFOFN-UHFFFAOYSA-N
Molecular Weight 520.434 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4598
Solvent DMSO-d6
Source Vendor ID: ZI/9066606; Lab Info: NKS; Lab Number: NKS-8200085