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5-bromo-3-{[3-(trifluoromethyl)benzoyl]amino}-1H-indole-2-carboxylic acid
SpectraBase Compound ID HzzgTI4zTOX
InChI InChI=1S/C17H10BrF3N2O3/c18-10-4-5-12-11(7-10)13(14(22-12)16(25)26)23-15(24)8-2-1-3-9(6-8)17(19,20)21/h1-7,22H,(H,23,24)(H,25,26)
InChIKey DYNNIBWCJZVCSD-UHFFFAOYSA-N
Mol Weight 427.18 g/mol
Molecular Formula C17H10BrF3N2O3
Exact Mass 425.98269 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID T3ddLS5zjM
Name 5-bromo-3-{[3-(trifluoromethyl)benzoyl]amino}-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/C17H10BrF3N2O3/c18-10-4-5-12-11(7-10)13(14(22-12)16(25)26)23-15(24)8-2-1-3-9(6-8)17(19,20)21/h1-7,22H,(H,23,24)(H,25,26)
InChIKey DYNNIBWCJZVCSD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_8519
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: 128071; Labnumber: SIMAK-00140; VK_ID: VK-008523
Temperature 315 °C