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5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl (1E)-N-(4-bromophenyl)-2-oxopropanehydrazonothioate

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5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl (1E)-N-(4-bromophenyl)-2-oxopropanehydrazonothioate
SpectraBase Compound ID Kcq0dkr3fQw
InChI InChI=1S/C19H18BrN5O2S/c1-12(26)18(23-21-15-8-6-14(20)7-9-15)28-19-24-22-17(25(19)2)13-4-10-16(27-3)11-5-13/h4-11,21H,1-3H3/b23-18+
InChIKey HCBMORSOYYARIW-PTGBLXJZSA-N
Mol Weight 460.35 g/mol
Molecular Formula C19H18BrN5O2S
Exact Mass 459.036459 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FhNv62XbqCo
Name 5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl (1E)-N-(4-bromophenyl)-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/C19H18BrN5O2S/c1-12(26)18(23-21-15-8-6-14(20)7-9-15)28-19-24-22-17(25(19)2)13-4-10-16(27-3)11-5-13/h4-11,21H,1-3H3/b23-18+
InChIKey HCBMORSOYYARIW-PTGBLXJZSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3630
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: 116134; Labnumber: SPGAL3-0021; VK_ID: VK-003631
Synonyms 5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl N-(4-bromophenyl)-2-oxopropanehydrazonothioate
Temperature 315 °C