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2,4-dichloro-N-[2-(4-ethyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
SpectraBase Compound ID 2b0HtS1nSMV
InChI InChI=1S/C13H14Cl2N4OS/c1-2-19-11(17-18-13(19)21)5-6-16-12(20)9-4-3-8(14)7-10(9)15/h3-4,7H,2,5-6H2,1H3,(H,16,20)(H,18,21)
InChIKey CFVMDKIOKRWZLW-UHFFFAOYSA-N
Mol Weight 345.25 g/mol
Molecular Formula C13H14Cl2N4OS
Exact Mass 344.026538 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HNL48hmORRQ
Name 2,4-dichloro-N-[2-(4-ethyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
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/C13H14Cl2N4OS/c1-2-19-11(17-18-13(19)21)5-6-16-12(20)9-4-3-8(14)7-10(9)15/h3-4,7H,2,5-6H2,1H3,(H,16,20)(H,18,21)
InChIKey CFVMDKIOKRWZLW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20428
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: D18699; Labnumber: MPOL-15949; SBI_ID: SBI-020432
Temperature 308 °C