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N-(2,5-dichlorophenyl)-2-{[4-(2-furylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 9TcgEHisctY
InChI InChI=1S/C21H16Cl2N4O2S/c22-15-8-9-17(23)18(11-15)24-19(28)13-30-21-26-25-20(14-5-2-1-3-6-14)27(21)12-16-7-4-10-29-16/h1-11H,12-13H2,(H,24,28)
InChIKey YBTVFGGWVZTCRC-UHFFFAOYSA-N
Mol Weight 459.35 g/mol
Molecular Formula C21H16Cl2N4O2S
Exact Mass 458.037102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DxKSJyy5ZXy
Name N-(2,5-dichlorophenyl)-2-{[4-(2-furylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C21H16Cl2N4O2S/c22-15-8-9-17(23)18(11-15)24-19(28)13-30-21-26-25-20(14-5-2-1-3-6-14)27(21)12-16-7-4-10-29-16/h1-11H,12-13H2,(H,24,28)
InChIKey YBTVFGGWVZTCRC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4029
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: D98434; Labnumber: GRES-20931; SBI_ID: SBI-004031
Temperature 308 °C