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3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID 8gTSm4Eqp01
InChI InChI=1S/C16H11ClF2N4O3S/c1-7-6-10(16(17,18)19)22-15-11(7)12(20)13(27-15)14(24)21-8-2-4-9(5-3-8)23(25)26/h2-6H,20H2,1H3,(H,21,24)
InChIKey VTAYWNDXQJUOBW-UHFFFAOYSA-N
Mol Weight 412.8 g/mol
Molecular Formula C16H11ClF2N4O3S
Exact Mass 412.020845 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GLC6tUGI84W
Name 3-amino-6-[chloro(difluoro)methyl]-4-methyl-N-(4-nitrophenyl)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/C16H11ClF2N4O3S/c1-7-6-10(16(17,18)19)22-15-11(7)12(20)13(27-15)14(24)21-8-2-4-9(5-3-8)23(25)26/h2-6H,20H2,1H3,(H,21,24)
InChIKey VTAYWNDXQJUOBW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11471
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: UZI/1267171; Labnumber: NIV1376; UZI_ID: UZI-011473
Temperature 308 °C