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1-(3-methoxyphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
SpectraBase Compound ID 2xRZRfEsjXz
InChI InChI=1S/C22H18N4O2S/c1-28-19-11-5-7-16(13-19)20(27)15-29-22-25-24-21(17-8-6-12-23-14-17)26(22)18-9-3-2-4-10-18/h2-14H,15H2,1H3
InChIKey NNUPMNBMEAXYJB-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C22H18N4O2S
Exact Mass 402.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 91Qlu7eKQxR
Name 1-(3-methoxyphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
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/C22H18N4O2S/c1-28-19-11-5-7-16(13-19)20(27)15-29-22-25-24-21(17-8-6-12-23-14-17)26(22)18-9-3-2-4-10-18/h2-14H,15H2,1H3
InChIKey NNUPMNBMEAXYJB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27356
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: D76275; Labnumber: MOR-8610; SBI_ID: SBI-027360
Temperature 315 °C