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4-[(3-cyano-5-methyl-4-phenyl-2-thienyl)amino]-4-oxobutanoic acid

View entire compound with spectra: 1 NMR

4-[(3-cyano-5-methyl-4-phenyl-2-thienyl)amino]-4-oxobutanoic acid
SpectraBase Compound ID 6ysXgmk7hZP
InChI InChI=1S/C16H14N2O3S/c1-10-15(11-5-3-2-4-6-11)12(9-17)16(22-10)18-13(19)7-8-14(20)21/h2-6H,7-8H2,1H3,(H,18,19)(H,20,21)
InChIKey GQKVCYSSZJYGLT-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C16H14N2O3S
Exact Mass 314.072513 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4u2wN2JVSTf
Name 4-[(3-cyano-5-methyl-4-phenyl-2-thienyl)amino]-4-oxobutanoic 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/C16H14N2O3S/c1-10-15(11-5-3-2-4-6-11)12(9-17)16(22-10)18-13(19)7-8-14(20)21/h2-6H,7-8H2,1H3,(H,18,19)(H,20,21)
InChIKey GQKVCYSSZJYGLT-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_19548
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/9195810; Labnumber: U_AM_ACK/001647; UZI_ID: UZI-019555
Temperature 308 °C