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2-{[4-(2-furylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-naphthyl)ethanone
SpectraBase Compound ID 1uUGwsyrUKn
InChI InChI=1S/C26H21N3O3S/c1-31-22-9-4-8-21(15-22)25-27-28-26(29(25)16-23-10-5-13-32-23)33-17-24(30)20-12-11-18-6-2-3-7-19(18)14-20/h2-15H,16-17H2,1H3
InChIKey CXALQGQCBMQKRR-UHFFFAOYSA-N
Mol Weight 455.53 g/mol
Molecular Formula C26H21N3O3S
Exact Mass 455.130363 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7K4A9aJqDZ
Name 2-{[4-(2-furylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-naphthyl)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/C26H21N3O3S/c1-31-22-9-4-8-21(15-22)25-27-28-26(29(25)16-23-10-5-13-32-23)33-17-24(30)20-12-11-18-6-2-3-7-19(18)14-20/h2-15H,16-17H2,1H3
InChIKey CXALQGQCBMQKRR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11465
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: E06367; Labnumber: GRES-21412; SBI_ID: SBI-011468
Temperature 308 °C