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benzo[b]thiophene-3-carboxylic acid, 2-amino-6-bromo-7-ethoxy-, ethyl ester
SpectraBase Compound ID 7iAID9tSfhj
InChI InChI=1S/C13H14BrNO3S/c1-3-17-10-8(14)6-5-7-9(13(16)18-4-2)12(15)19-11(7)10/h5-6H,3-4,15H2,1-2H3
InChIKey KSIZMUBFKCWQRO-UHFFFAOYSA-N
Mol Weight 344.22 g/mol
Molecular Formula C13H14BrNO3S
Exact Mass 342.987777 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EYR6Lp2ZwPY
Name benzo[b]thiophene-3-carboxylic acid, 2-amino-6-bromo-7-ethoxy-, ethyl ester
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/C13H14BrNO3S/c1-3-17-10-8(14)6-5-7-9(13(16)18-4-2)12(15)19-11(7)10/h5-6H,3-4,15H2,1-2H3
InChIKey KSIZMUBFKCWQRO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2112
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: ZI/6012686; Labnumber: SMM-588; IOH_ID: IOH-009115