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ethanediamide, N~1~-[3-(aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-
SpectraBase Compound ID DSiLshMmOJH
InChI InChI=1S/C21H25N3O5S/c1-28-14-8-7-12(11-15(14)29-2)9-10-23-19(26)20(27)24-21-17(18(22)25)13-5-3-4-6-16(13)30-21/h7-8,11H,3-6,9-10H2,1-2H3,(H2,22,25)(H,23,26)(H,24,27)
InChIKey FVIIKINMZDFUPJ-UHFFFAOYSA-N
Mol Weight 431.51 g/mol
Molecular Formula C21H25N3O5S
Exact Mass 431.151492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ls5PkyYZjNC
Name ethanediamide, N~1~-[3-(aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-
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/C21H25N3O5S/c1-28-14-8-7-12(11-15(14)29-2)9-10-23-19(26)20(27)24-21-17(18(22)25)13-5-3-4-6-16(13)30-21/h7-8,11H,3-6,9-10H2,1-2H3,(H2,22,25)(H,23,26)(H,24,27)
InChIKey FVIIKINMZDFUPJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5546
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/17211192; Labnumber: ARJ-5684