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3-amino-6-(3-methoxyphenyl)-N-[3-(trifluoromethyl)benzyl]thieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID 5MTAe8rFL27
InChI InChI=1S/C23H18F3N3O2S/c1-31-16-7-3-5-14(11-16)18-9-8-17-19(27)20(32-22(17)29-18)21(30)28-12-13-4-2-6-15(10-13)23(24,25)26/h2-11H,12,27H2,1H3,(H,28,30)
InChIKey NJMLFBQBCKFDTM-UHFFFAOYSA-N
Mol Weight 457.47 g/mol
Molecular Formula C23H18F3N3O2S
Exact Mass 457.107182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gkk0NoxBqPY
Name 3-amino-6-(3-methoxyphenyl)-N-[3-(trifluoromethyl)benzyl]thieno[2,3-b]pyridine-2-carboxamide
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/C23H18F3N3O2S/c1-31-16-7-3-5-14(11-16)18-9-8-17-19(27)20(32-22(17)29-18)21(30)28-12-13-4-2-6-15(10-13)23(24,25)26/h2-11H,12,27H2,1H3,(H,28,30)
InChIKey NJMLFBQBCKFDTM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10571
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: 132657; Labnumber: SHES1-218; VK_ID: VK-010575
Temperature 318 °C