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2-(4-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}-1-piperazinyl)ethanol
SpectraBase Compound ID 1OAeS3sm90L
InChI InChI=1S/C15H20N6O3S/c1-18-11-16-17-15(18)25-14-10-12(2-3-13(14)21(23)24)20-6-4-19(5-7-20)8-9-22/h2-3,10-11,22H,4-9H2,1H3
InChIKey AWWRQVTYFQOGEH-UHFFFAOYSA-N
Mol Weight 364.42 g/mol
Molecular Formula C15H20N6O3S
Exact Mass 364.13176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JPTpXsvdqJp
Name 2-(4-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}-1-piperazinyl)ethanol
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/C15H20N6O3S/c1-18-11-16-17-15(18)25-14-10-12(2-3-13(14)21(23)24)20-6-4-19(5-7-20)8-9-22/h2-3,10-11,22H,4-9H2,1H3
InChIKey AWWRQVTYFQOGEH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2136
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/9311077; Labnumber: LP-0001053