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2-{[(2E)-2-cyano-3-(3-methyl-2-thienyl)-2-propenoyl]amino}benzoic acid
SpectraBase Compound ID 40ZrRjP0XtQ
InChI InChI=1S/C16H12N2O3S/c1-10-6-7-22-14(10)8-11(9-17)15(19)18-13-5-3-2-4-12(13)16(20)21/h2-8H,1H3,(H,18,19)(H,20,21)/b11-8+
InChIKey VYFTXLWDJCHZGR-DHZHZOJOSA-N
Mol Weight 312.34 g/mol
Molecular Formula C16H12N2O3S
Exact Mass 312.056863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I6ZQVzT7DIY
Name 2-{[(2E)-2-cyano-3-(3-methyl-2-thienyl)-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/C16H12N2O3S/c1-10-6-7-22-14(10)8-11(9-17)15(19)18-13-5-3-2-4-12(13)16(20)21/h2-8H,1H3,(H,18,19)(H,20,21)/b11-8+
InChIKey VYFTXLWDJCHZGR-DHZHZOJOSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11106
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: 1003344; UBI_ID: UBI-011109
Synonyms 2-{[2-cyano-3-(3-methyl-2-thienyl)-2-propenoyl]amino}benzoic acid
Temperature 308 °C