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acetic acid, [[3-cyano-4-(2,4-dichlorophenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, methyl ester
SpectraBase Compound ID Bu7YnNEn8Wl
InChI InChI=1S/C15H12Cl2N2O3S/c1-22-14(21)7-23-15-11(6-18)10(5-13(20)19-15)9-3-2-8(16)4-12(9)17/h2-4,10H,5,7H2,1H3,(H,19,20)
InChIKey MDRBKBWZWWMIFX-UHFFFAOYSA-N
Mol Weight 371.24 g/mol
Molecular Formula C15H12Cl2N2O3S
Exact Mass 369.994569 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G2PSdNMUMXj
Name acetic acid, [[3-cyano-4-(2,4-dichlorophenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, methyl ester
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/C15H12Cl2N2O3S/c1-22-14(21)7-23-15-11(6-18)10(5-13(20)19-15)9-3-2-8(16)4-12(9)17/h2-4,10H,5,7H2,1H3,(H,19,20)
InChIKey MDRBKBWZWWMIFX-UHFFFAOYSA-N
NMR Offset 18.5111
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_CB_8313_2254
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/9248152; Labnumber: *0866234*
Temperature 323 °C