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1,3-benzenedicarboxylic acid, 5-[[3-[(4-bromophenyl)sulfonyl]-1-oxopropyl]amino]-, dimethyl ester

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1,3-benzenedicarboxylic acid, 5-[[3-[(4-bromophenyl)sulfonyl]-1-oxopropyl]amino]-, dimethyl ester
SpectraBase Compound ID HMDBMHCFTM9
InChI InChI=1S/C19H18BrNO7S/c1-27-18(23)12-9-13(19(24)28-2)11-15(10-12)21-17(22)7-8-29(25,26)16-5-3-14(20)4-6-16/h3-6,9-11H,7-8H2,1-2H3,(H,21,22)
InChIKey GYAPEXXFQLEWQW-UHFFFAOYSA-N
Mol Weight 484.32 g/mol
Molecular Formula C19H18BrNO7S
Exact Mass 482.998736 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8sD3rXuvWum
Name 1,3-benzenedicarboxylic acid, 5-[[3-[(4-bromophenyl)sulfonyl]-1-oxopropyl]amino]-, dimethyl 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/C19H18BrNO7S/c1-27-18(23)12-9-13(19(24)28-2)11-15(10-12)21-17(22)7-8-29(25,26)16-5-3-14(20)4-6-16/h3-6,9-11H,7-8H2,1-2H3,(H,21,22)
InChIKey GYAPEXXFQLEWQW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7573
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/12238289