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methyl 6-methyl-2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 7EoJzBBbMCQ
InChI InChI=1S/C28H26N2O3S/c1-16-7-6-8-18(13-16)23-15-21(19-9-4-5-10-22(19)29-23)26(31)30-27-25(28(32)33-3)20-12-11-17(2)14-24(20)34-27/h4-10,13,15,17H,11-12,14H2,1-3H3,(H,30,31)
InChIKey BKRAENCGDYRIII-UHFFFAOYSA-N
Mol Weight 470.59 g/mol
Molecular Formula C28H26N2O3S
Exact Mass 470.166414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LXCJwoHgp15
Name methyl 6-methyl-2-({[2-(3-methylphenyl)-4-quinolinyl]carbonyl}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/C28H26N2O3S/c1-16-7-6-8-18(13-16)23-15-21(19-9-4-5-10-22(19)29-23)26(31)30-27-25(28(32)33-3)20-12-11-17(2)14-24(20)34-27/h4-10,13,15,17H,11-12,14H2,1-3H3,(H,30,31)
InChIKey BKRAENCGDYRIII-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2973
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/8076176; UBI_ID: UBI-002974
Temperature 313 °C