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ethyl 2-{[(3,4-dichloro-1-benzothien-2-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID HIMDMXKKy5m
InChI InChI=1S/C21H19Cl2NO3S2/c1-3-27-21(26)15-11-8-7-10(2)9-14(11)29-20(15)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 RJACNFAAOBQIID-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 4fZ9g4aX0zR
Name ethyl 2-{[(3,4-dichloro-1-benzothien-2-yl)carbonyl]amino}-6-methyl-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/c1-3-27-21(26)15-11-8-7-10(2)9-14(11)29-20(15)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 RJACNFAAOBQIID-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15264
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/9314076; Labnumber: NSB-0097252; UZI_ID: UZI-015268
Temperature 308 °C