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5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl (1E)-N-(4-methoxyphenyl)-2-oxopropanehydrazonothioate
SpectraBase Compound ID JO2Alfzr6Sz
InChI InChI=1S/C20H21N5O3S/c1-13(26)19(23-21-15-7-11-17(28-4)12-8-15)29-20-24-22-18(25(20)2)14-5-9-16(27-3)10-6-14/h5-12,21H,1-4H3/b23-19+
InChIKey GUQVMWHKJQODBL-FCDQGJHFSA-N
Mol Weight 411.48 g/mol
Molecular Formula C20H21N5O3S
Exact Mass 411.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1bUYr9ParRr
Name 5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl (1E)-N-(4-methoxyphenyl)-2-oxopropanehydrazonothioate
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/C20H21N5O3S/c1-13(26)19(23-21-15-7-11-17(28-4)12-8-15)29-20-24-22-18(25(20)2)14-5-9-16(27-3)10-6-14/h5-12,21H,1-4H3/b23-19+
InChIKey GUQVMWHKJQODBL-FCDQGJHFSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3632
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: 116136; Labnumber: SPGAL3-0023; VK_ID: VK-003633
Synonyms 5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl N-(4-methoxyphenyl)-2-oxopropanehydrazonothioate
Temperature 315 °C