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1H-pyrrole-3-carboxylic acid, 4,5-dihydro-2-methyl-5-[[4-(methylthio)phenyl]methylene]-4-oxo-, methyl ester, (5E)-
SpectraBase Compound ID TWVs2CNCb0
InChI InChI=1S/C15H15NO3S/c1-9-13(15(18)19-2)14(17)12(16-9)8-10-4-6-11(20-3)7-5-10/h4-8,16H,1-3H3/b12-8+
InChIKey CKVPSNSPQYOMTG-XYOKQWHBSA-N
Mol Weight 289.35 g/mol
Molecular Formula C15H15NO3S
Exact Mass 289.077265 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AWxeEN23yuu
Name 1H-pyrrole-3-carboxylic acid, 4,5-dihydro-2-methyl-5-[[4-(methylthio)phenyl]methylene]-4-oxo-, methyl ester, (5E)-
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/C15H15NO3S/c1-9-13(15(18)19-2)14(17)12(16-9)8-10-4-6-11(20-3)7-5-10/h4-8,16H,1-3H3/b12-8+
InChIKey CKVPSNSPQYOMTG-XYOKQWHBSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_CB_8313_2215
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: NMR/9245971; Labnumber: LD-0809787
Temperature 313 °C