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ethanol, 2-[[1-[(4-chlorophenyl)methyl]-2-methyl-4-nitro-1H-imidazol-5-yl]thio]-
SpectraBase Compound ID JvG4kNLQ0VY
InChI InChI=1S/C13H14ClN3O3S/c1-9-15-12(17(19)20)13(21-7-6-18)16(9)8-10-2-4-11(14)5-3-10/h2-5,18H,6-8H2,1H3
InChIKey GTGFXPSOEGFLSD-UHFFFAOYSA-N
Mol Weight 327.79 g/mol
Molecular Formula C13H14ClN3O3S
Exact Mass 327.04444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A9ia2tjVvh5
Name ethanol, 2-[[1-[(4-chlorophenyl)methyl]-2-methyl-4-nitro-1H-imidazol-5-yl]thio]-
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/C13H14ClN3O3S/c1-9-15-12(17(19)20)13(21-7-6-18)16(9)8-10-2-4-11(14)5-3-10/h2-5,18H,6-8H2,1H3
InChIKey GTGFXPSOEGFLSD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_905
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: AG-205/5054318; Labnumber: AGG-429; IOH_ID: IOH-007907