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isopropyl 2-({5-[(4-ethylphenoxy)methyl]-2-furoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID JdsTUNLYoll
InChI InChI=1S/C26H29NO5S/c1-4-17-9-11-18(12-10-17)30-15-19-13-14-21(32-19)24(28)27-25-23(26(29)31-16(2)3)20-7-5-6-8-22(20)33-25/h9-14,16H,4-8,15H2,1-3H3,(H,27,28)
InChIKey AEJCGYVRMZFRBY-UHFFFAOYSA-N
Mol Weight 467.58 g/mol
Molecular Formula C26H29NO5S
Exact Mass 467.176644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 250wkUO8UXI
Name isopropyl 2-({5-[(4-ethylphenoxy)methyl]-2-furoyl}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/C26H29NO5S/c1-4-17-9-11-18(12-10-17)30-15-19-13-14-21(32-19)24(28)27-25-23(26(29)31-16(2)3)20-7-5-6-8-22(20)33-25/h9-14,16H,4-8,15H2,1-3H3,(H,27,28)
InChIKey AEJCGYVRMZFRBY-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5314
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/8149831; UBI_ID: UBI-005316
Temperature 313 °C