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methyl 2-{[(3,4-dichloro-1-benzothien-2-yl)carbonyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID KkrcheaJKIW
InChI InChI=1S/C21H19Cl2NO3S2/c1-3-10-7-8-11-14(9-10)29-20(15(11)21(26)27-2)24-19(25)18-17(23)16-12(22)5-4-6-13(16)28-18/h4-6,10H,3,7-9H2,1-2H3,(H,24,25)
InChIKey HVGPUAJUWPKVFO-UHFFFAOYSA-N
Mol Weight 468.41 g/mol
Molecular Formula C21H19Cl2NO3S2
Exact Mass 467.018341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HQYvvKJUIHv
Name methyl 2-{[(3,4-dichloro-1-benzothien-2-yl)carbonyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C21H19Cl2NO3S2/c1-3-10-7-8-11-14(9-10)29-20(15(11)21(26)27-2)24-19(25)18-17(23)16-12(22)5-4-6-13(16)28-18/h4-6,10H,3,7-9H2,1-2H3,(H,24,25)
InChIKey HVGPUAJUWPKVFO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15273
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: UZI/9314160; Labnumber: NSB-0097282; UZI_ID: UZI-015277
Temperature 308 °C