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2-{[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridinyl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID 7uU4dOtGrw6
InChI InChI=1S/C23H18F3N3O3S/c1-31-19-10-8-14(11-20(19)32-2)17-9-7-15(12-27)22(29-17)33-13-21(30)28-18-6-4-3-5-16(18)23(24,25)26/h3-11H,13H2,1-2H3,(H,28,30)
InChIKey XYSSUKZCCIFHMN-UHFFFAOYSA-N
Mol Weight 473.47 g/mol
Molecular Formula C23H18F3N3O3S
Exact Mass 473.102097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LmxOV1pidZb
Name 2-{[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridinyl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H18F3N3O3S/c1-31-19-10-8-14(11-20(19)32-2)17-9-7-15(12-27)22(29-17)33-13-21(30)28-18-6-4-3-5-16(18)23(24,25)26/h3-11H,13H2,1-2H3,(H,28,30)
InChIKey XYSSUKZCCIFHMN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10605
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 132694; Labnumber: SHES1-255; VK_ID: VK-010609
Temperature 318 °C