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benzoic acid, 4-[[[2-[[(3,4-dimethoxyphenyl)methyl]amino]-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]carbonyl]amino]-, ethyl ester

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benzoic acid, 4-[[[2-[[(3,4-dimethoxyphenyl)methyl]amino]-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]carbonyl]amino]-, ethyl ester
SpectraBase Compound ID DJblmXVv0G3
InChI InChI=1S/C27H30N2O5S/c1-4-34-27(31)18-10-12-19(13-11-18)29-25(30)24-20-7-5-6-8-23(20)35-26(24)28-16-17-9-14-21(32-2)22(15-17)33-3/h9-15,28H,4-8,16H2,1-3H3,(H,29,30)
InChIKey SXGQUUSDSQRMNB-UHFFFAOYSA-N
Mol Weight 494.61 g/mol
Molecular Formula C27H30N2O5S
Exact Mass 494.187543 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BSyz8PrMLqw
Name benzoic acid, 4-[[[2-[[(3,4-dimethoxyphenyl)methyl]amino]-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]carbonyl]amino]-, 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/C27H30N2O5S/c1-4-34-27(31)18-10-12-19(13-11-18)29-25(30)24-20-7-5-6-8-23(20)35-26(24)28-16-17-9-14-21(32-2)22(15-17)33-3/h9-15,28H,4-8,16H2,1-3H3,(H,29,30)
InChIKey SXGQUUSDSQRMNB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5608
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/11288358