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2-{[4-(4-chloro-2-methylphenoxy)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID H8oPQh9BSP3
InChI InChI=1S/C20H23ClN2O3S/c1-12-11-13(21)8-9-15(12)26-10-4-7-17(24)23-20-18(19(22)25)14-5-2-3-6-16(14)27-20/h8-9,11H,2-7,10H2,1H3,(H2,22,25)(H,23,24)
InChIKey HNHRMFYVXZXTSO-UHFFFAOYSA-N
Mol Weight 406.93 g/mol
Molecular Formula C20H23ClN2O3S
Exact Mass 406.111791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EO8taRjq9zT
Name 2-{[4-(4-chloro-2-methylphenoxy)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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/C20H23ClN2O3S/c1-12-11-13(21)8-9-15(12)26-10-4-7-17(24)23-20-18(19(22)25)14-5-2-3-6-16(14)27-20/h8-9,11H,2-7,10H2,1H3,(H2,22,25)(H,23,24)
InChIKey HNHRMFYVXZXTSO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_12554
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/6227726; Labnumber: NSB0008209; UZI_ID: UZI-012558
Temperature 308 °C