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3-{[(4-fluorophenyl)sulfonyl]amino}-5-methyl-1H-indole-2-carboxylic acid
SpectraBase Compound ID CqnZ8nbKl97
InChI InChI=1S/C16H13FN2O4S/c1-9-2-7-13-12(8-9)14(15(18-13)16(20)21)19-24(22,23)11-5-3-10(17)4-6-11/h2-8,18-19H,1H3,(H,20,21)
InChIKey IXRUQXAFHFFLPC-UHFFFAOYSA-N
Mol Weight 348.35 g/mol
Molecular Formula C16H13FN2O4S
Exact Mass 348.058006 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BnNSKiPXPun
Name 3-{[(4-fluorophenyl)sulfonyl]amino}-5-methyl-1H-indole-2-carboxylic acid
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/C16H13FN2O4S/c1-9-2-7-13-12(8-9)14(15(18-13)16(20)21)19-24(22,23)11-5-3-10(17)4-6-11/h2-8,18-19H,1H3,(H,20,21)
InChIKey IXRUQXAFHFFLPC-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_8526
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: 128080; Labnumber: SIMAK-00149; VK_ID: VK-008530
Temperature 315 °C