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ethyl 2-[((2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID 4bXSW5ebdpL
InChI InChI=1S/C26H26BrNO5S/c1-5-32-26(30)24-16(2)17(3)34-25(24)28-23(29)13-7-18-6-12-22(31-4)19(14-18)15-33-21-10-8-20(27)9-11-21/h6-14H,5,15H2,1-4H3,(H,28,29)/b13-7+
InChIKey XWHYRMNJUUFINX-NTUHNPAUSA-N
Mol Weight 544.46 g/mol
Molecular Formula C26H26BrNO5S
Exact Mass 543.071507 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FvcH2KK2bhH
Name ethyl 2-[((2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
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/C26H26BrNO5S/c1-5-32-26(30)24-16(2)17(3)34-25(24)28-23(29)13-7-18-6-12-22(31-4)19(14-18)15-33-21-10-8-20(27)9-11-21/h6-14H,5,15H2,1-4H3,(H,28,29)/b13-7+
InChIKey XWHYRMNJUUFINX-NTUHNPAUSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10200
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/1031162; Labnumber: JVT4215; UZI_ID: UZI-010202
Synonyms ethyl 2-[(3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
Temperature 305 °C