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ethyl 6-tert-butyl-2-{[(4-fluorophenyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IvSQ0SXFnfV
InChI InChI=1S/C23H28FNO3S/c1-5-28-22(27)20-17-11-8-15(23(2,3)4)13-18(17)29-21(20)25-19(26)12-14-6-9-16(24)10-7-14/h6-7,9-10,15H,5,8,11-13H2,1-4H3,(H,25,26)
InChIKey XLGPPSLHSRVJMH-UHFFFAOYSA-N
Mol Weight 417.54 g/mol
Molecular Formula C23H28FNO3S
Exact Mass 417.177393 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BmD0bTkzY68
Name ethyl 6-tert-butyl-2-{[(4-fluorophenyl)acetyl]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/C23H28FNO3S/c1-5-28-22(27)20-17-11-8-15(23(2,3)4)13-18(17)29-21(20)25-19(26)12-14-6-9-16(24)10-7-14/h6-7,9-10,15H,5,8,11-13H2,1-4H3,(H,25,26)
InChIKey XLGPPSLHSRVJMH-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4010
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/8110722; UBI_ID: UBI-004011
Temperature 308 °C