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2-({(2E)-2-cyano-3-[3-ethoxy-4-(1-naphthylmethoxy)phenyl]-2-propenoyl}amino)benzoic acid
SpectraBase Compound ID BtTl7nNKP9t
InChI InChI=1S/C30H24N2O5/c1-2-36-28-17-20(16-23(18-31)29(33)32-26-13-6-5-12-25(26)30(34)35)14-15-27(28)37-19-22-10-7-9-21-8-3-4-11-24(21)22/h3-17H,2,19H2,1H3,(H,32,33)(H,34,35)/b23-16+
InChIKey QKXHDGGETFOYAO-XQNSMLJCSA-N
Mol Weight 492.53 g/mol
Molecular Formula C30H24N2O5
Exact Mass 492.168522 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2CMBohzVR75
Name 2-({(2E)-2-cyano-3-[3-ethoxy-4-(1-naphthylmethoxy)phenyl]-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/C30H24N2O5/c1-2-36-28-17-20(16-23(18-31)29(33)32-26-13-6-5-12-25(26)30(34)35)14-15-27(28)37-19-22-10-7-9-21-8-3-4-11-24(21)22/h3-17H,2,19H2,1H3,(H,32,33)(H,34,35)/b23-16+
InChIKey QKXHDGGETFOYAO-XQNSMLJCSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5202
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: 9589644; UBI_ID: UBI-005204
Synonyms 2-({2-cyano-3-[3-ethoxy-4-(1-naphthylmethoxy)phenyl]-2-propenoyl}amino)benzoic acid
Temperature 308 °C