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3-({(2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-2-cyano-2-propenoyl}amino)benzoic acid
SpectraBase Compound ID GOVuiF22q8j
InChI InChI=1S/C26H19N3O4/c27-14-19(25(30)29-21-8-4-7-18(12-21)26(31)32)11-20-15-28-24-10-9-22(13-23(20)24)33-16-17-5-2-1-3-6-17/h1-13,15,28H,16H2,(H,29,30)(H,31,32)/b19-11+
InChIKey NPEHQUHWGPVTGK-YBFXNURJSA-N
Mol Weight 437.46 g/mol
Molecular Formula C26H19N3O4
Exact Mass 437.137556 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HocrGk2g3Ih
Name 3-({(2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-2-cyano-2-propenoyl}amino)benzoic acid
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/C26H19N3O4/c27-14-19(25(30)29-21-8-4-7-18(12-21)26(31)32)11-20-15-28-24-10-9-22(13-23(20)24)33-16-17-5-2-1-3-6-17/h1-13,15,28H,16H2,(H,29,30)(H,31,32)/b19-11+
InChIKey NPEHQUHWGPVTGK-YBFXNURJSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UZI_26187_2824
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/1010767; Labnumber: ARF4032; UZI_ID: UZI-002826
Synonyms 3-({3-[5-(benzyloxy)-1H-indol-3-yl]-2-cyano-2-propenoyl}amino)benzoic acid
Temperature 300 °C