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benzo[b]thiophene-3-carboxylic acid, 2-[(3-butoxybenzoyl)amino]-4,5,6,7-tetrahydro-, ethyl ester
SpectraBase Compound ID Je6J0No5e93
InChI InChI=1S/C22H27NO4S/c1-3-5-13-27-16-10-8-9-15(14-16)20(24)23-21-19(22(25)26-4-2)17-11-6-7-12-18(17)28-21/h8-10,14H,3-7,11-13H2,1-2H3,(H,23,24)
InChIKey GPSCRVUCZALRGI-UHFFFAOYSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C8jNne8TZ4P
Name benzo[b]thiophene-3-carboxylic acid, 2-[(3-butoxybenzoyl)amino]-4,5,6,7-tetrahydro-, ethyl ester
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/C22H27NO4S/c1-3-5-13-27-16-10-8-9-15(14-16)20(24)23-21-19(22(25)26-4-2)17-11-6-7-12-18(17)28-21/h8-10,14H,3-7,11-13H2,1-2H3,(H,23,24)
InChIKey GPSCRVUCZALRGI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1379
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: NMR/11259561