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(2Z)-4-oxo-4-[2-(phenylethynyl)anilino]-2-butenoic acid

View entire compound with spectra: 2 NMR

(2Z)-4-oxo-4-[2-(phenylethynyl)anilino]-2-butenoic acid
SpectraBase Compound ID CpfgI9kfdJS
InChI InChI=1S/C18H13NO3/c20-17(12-13-18(21)22)19-16-9-5-4-8-15(16)11-10-14-6-2-1-3-7-14/h1-9,12-13H,(H,19,20)(H,21,22)/b13-12-
InChIKey HHHFPVVMOBYDSB-SEYXRHQNSA-N
Mol Weight 291.31 g/mol
Molecular Formula C18H13NO3
Exact Mass 291.089543 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6PhRzAnhWVk
Name (2Z)-4-oxo-4-[2-(phenylethynyl)anilino]-2-butenoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H13NO3/c20-17(12-13-18(21)22)19-16-9-5-4-8-15(16)11-10-14-6-2-1-3-7-14/h1-9,12-13H,(H,19,20)(H,21,22)/b13-12-
InChIKey HHHFPVVMOBYDSB-SEYXRHQNSA-N
NMR Offset 15.1248
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3381
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: ZI/7010639; Labnumber: RAI-0000048; IOH_ID: IOH-003382
Synonyms 4-oxo-4-[2-(phenylethynyl)anilino]-2-butenoic acid
Temperature 313 °C