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2-chloro-5-{5-[(1E)-2-cyano-3-(3-ethoxyanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
SpectraBase Compound ID D1rqNhVuV5H
InChI InChI=1S/C23H17ClN2O5/c1-2-30-17-5-3-4-16(12-17)26-22(27)15(13-25)10-18-7-9-21(31-18)14-6-8-20(24)19(11-14)23(28)29/h3-12H,2H2,1H3,(H,26,27)(H,28,29)/b15-10+
InChIKey OTKIHHDDTNZOBF-XNTDXEJSSA-N
Mol Weight 436.85 g/mol
Molecular Formula C23H17ClN2O5
Exact Mass 436.082599 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7AHLA0uMrTL
Name 2-chloro-5-{5-[(1E)-2-cyano-3-(3-ethoxyanilino)-3-oxo-1-propenyl]-2-furyl}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/C23H17ClN2O5/c1-2-30-17-5-3-4-16(12-17)26-22(27)15(13-25)10-18-7-9-21(31-18)14-6-8-20(24)19(11-14)23(28)29/h3-12H,2H2,1H3,(H,26,27)(H,28,29)/b15-10+
InChIKey OTKIHHDDTNZOBF-XNTDXEJSSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9382
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: 133331; Labnumber: AREF2K-0252; VK_ID: VK-009386
Synonyms 2-chloro-5-{5-[2-cyano-3-(3-ethoxyanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature 308 °C