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ethyl 2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IgoDiCrOuk5
InChI InChI=1S/C23H29NO4S/c1-5-18(28-16-12-11-14(3)15(4)13-16)21(25)24-22-20(23(26)27-6-2)17-9-7-8-10-19(17)29-22/h11-13,18H,5-10H2,1-4H3,(H,24,25)
InChIKey NUTAPOCPXHODQP-UHFFFAOYSA-N
Mol Weight 415.55 g/mol
Molecular Formula C23H29NO4S
Exact Mass 415.18173 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HDqfnjgXWig
Name ethyl 2-{[2-(3,4-dimethylphenoxy)butanoyl]amino}-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/C23H29NO4S/c1-5-18(28-16-12-11-14(3)15(4)13-16)21(25)24-22-20(23(26)27-6-2)17-9-7-8-10-19(17)29-22/h11-13,18H,5-10H2,1-4H3,(H,24,25)
InChIKey NUTAPOCPXHODQP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15612
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/1003606; Labnumber: NSB-0099351; UZI_ID: UZI-015616
Temperature 308 °C