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1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-furyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

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1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-furyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
SpectraBase Compound ID 4amhhyaBIDH
InChI InChI=1S/C22H17N3O4S/c26-17(15-8-9-18-20(13-15)29-12-11-28-18)14-30-22-24-23-21(19-7-4-10-27-19)25(22)16-5-2-1-3-6-16/h1-10,13H,11-12,14H2
InChIKey NKRXTPXULRNKAO-UHFFFAOYSA-N
Mol Weight 419.46 g/mol
Molecular Formula C22H17N3O4S
Exact Mass 419.093977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LC962so0RUN
Name 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-furyl)-4-phenyl-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/C22H17N3O4S/c26-17(15-8-9-18-20(13-15)29-12-11-28-18)14-30-22-24-23-21(19-7-4-10-27-19)25(22)16-5-2-1-3-6-16/h1-10,13H,11-12,14H2
InChIKey NKRXTPXULRNKAO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6571
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/11261426; Labnumber: LP-2111070; IOH_ID: IOH-006572