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benzo[b]thiophene-3-carboxylic acid, 2-amino-6-bromo-7-(phenylmethoxy)-, ethyl ester
SpectraBase Compound ID 891V2k6PVcJ
InChI InChI=1S/C18H16BrNO3S/c1-2-22-18(21)14-12-8-9-13(19)15(16(12)24-17(14)20)23-10-11-6-4-3-5-7-11/h3-9H,2,10,20H2,1H3
InChIKey QVLUVQXRHLQIOL-UHFFFAOYSA-N
Mol Weight 406.29 g/mol
Molecular Formula C18H16BrNO3S
Exact Mass 405.003428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6dAcOjwBSKc
Name benzo[b]thiophene-3-carboxylic acid, 2-amino-6-bromo-7-(phenylmethoxy)-, 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/C18H16BrNO3S/c1-2-22-18(21)14-12-8-9-13(19)15(16(12)24-17(14)20)23-10-11-6-4-3-5-7-11/h3-9H,2,10,20H2,1H3
InChIKey QVLUVQXRHLQIOL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5148
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: NMR/12218727