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2-{[(3-cyano-4,5-dimethyl-2-thienyl)amino]carbonyl}benzoic acid
SpectraBase Compound ID CZJZWsTrO4F
InChI InChI=1S/C15H12N2O3S/c1-8-9(2)21-14(12(8)7-16)17-13(18)10-5-3-4-6-11(10)15(19)20/h3-6H,1-2H3,(H,17,18)(H,19,20)
InChIKey KDDSFSOYTBBKRM-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C15H12N2O3S
Exact Mass 300.056863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EfHelxyEIz3
Name 2-{[(3-cyano-4,5-dimethyl-2-thienyl)amino]carbonyl}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/C15H12N2O3S/c1-8-9(2)21-14(12(8)7-16)17-13(18)10-5-3-4-6-11(10)15(19)20/h3-6H,1-2H3,(H,17,18)(H,19,20)
InChIKey KDDSFSOYTBBKRM-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_883
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/6011346; Labnumber: DK-5407; IOH_ID: IOH-000884
Temperature 303 °C