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2-[((2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-5-isopropyl-3-thiophenecarboxamide
SpectraBase Compound ID KK8aF2pW2bg
InChI InChI=1S/C25H25BrN2O4S/c1-15(2)22-13-20(24(27)30)25(33-22)28-23(29)11-5-16-4-10-21(31-3)17(12-16)14-32-19-8-6-18(26)7-9-19/h4-13,15H,14H2,1-3H3,(H2,27,30)(H,28,29)/b11-5+
InChIKey OIRAVYUNRXWWKM-VZUCSPMQSA-N
Mol Weight 529.45 g/mol
Molecular Formula C25H25BrN2O4S
Exact Mass 528.071841 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LQE1nPZ4aaq
Name 2-[((2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-5-isopropyl-3-thiophenecarboxamide
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/C25H25BrN2O4S/c1-15(2)22-13-20(24(27)30)25(33-22)28-23(29)11-5-16-4-10-21(31-3)17(12-16)14-32-19-8-6-18(26)7-9-19/h4-13,15H,14H2,1-3H3,(H2,27,30)(H,28,29)/b11-5+
InChIKey OIRAVYUNRXWWKM-VZUCSPMQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11158
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/1026557; Labnumber: MVY0373; UZI_ID: UZI-011160
Synonyms 2-[(3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenoyl)amino]-5-isopropyl-3-thiophenecarboxamide
Temperature 318 °C