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N-(4-chloro-3-nitrophenyl)-2-[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
SpectraBase Compound ID K3N25QbCMUU
InChI InChI=1S/C12H12ClN5O3S/c1-7-15-16-12(17(7)2)22-6-11(19)14-8-3-4-9(13)10(5-8)18(20)21/h3-5H,6H2,1-2H3,(H,14,19)
InChIKey LTYBDNCRJSINHX-UHFFFAOYSA-N
Mol Weight 341.77 g/mol
Molecular Formula C12H12ClN5O3S
Exact Mass 341.034938 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 800VjoTLZxG
Name N-(4-chloro-3-nitrophenyl)-2-[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
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/C12H12ClN5O3S/c1-7-15-16-12(17(7)2)22-6-11(19)14-8-3-4-9(13)10(5-8)18(20)21/h3-5H,6H2,1-2H3,(H,14,19)
InChIKey LTYBDNCRJSINHX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8095
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: UZI/1269901; Labnumber: COL6784; UZI_ID: UZI-008097
Temperature 318 °C