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3-Amino-N-(3-iodo-4-methyl-phenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID GPzARJYQZIY
InChI InChI=1S/C17H13F3IN3OS/c1-7-3-4-9(6-10(7)21)23-15(25)14-13(22)12-8(2)5-11(17(18,19)20)24-16(12)26-14/h3-6H,22H2,1-2H3,(H,23,25)
InChIKey IRWZIRXQQUKFGL-UHFFFAOYSA-N
Mol Weight 491.27 g/mol
Molecular Formula C17H13F3IN3OS
Exact Mass 490.977613 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G79zFEvuxtK
Name thieno[2,3-b]pyridine-2-carboxamide, 3-amino-N-(3-iodo-4-methylphenyl)-4-methyl-6-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.977612713 u
Formula C17H13F3IN3OS
InChI InChI=1S/C17H13F3IN3OS/c1-7-3-4-9(6-10(7)21)23-15(25)14-13(22)12-8(2)5-11(17(18,19)20)24-16(12)26-14/h3-6H,22H2,1-2H3,(H,23,25)
InChIKey IRWZIRXQQUKFGL-UHFFFAOYSA-N
Molecular Weight 491.271 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17888
Solvent DMSO-d6
Source Vendor ID: NMR/11280907; Lab Info: TSH; Lab Number: A0171/0007690