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4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl 4-nitrobenzyl sulfide

View entire compound with spectra: 1 NMR

4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl 4-nitrobenzyl sulfide
SpectraBase Compound ID HUhJIvGB5xF
InChI InChI=1S/C18H15ClN4O2S/c1-2-11-22-17(14-5-7-15(19)8-6-14)20-21-18(22)26-12-13-3-9-16(10-4-13)23(24)25/h2-10H,1,11-12H2
InChIKey CDENDHUIAJFZPY-UHFFFAOYSA-N
Mol Weight 386.86 g/mol
Molecular Formula C18H15ClN4O2S
Exact Mass 386.060425 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1frws8yMkF
Name 4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl 4-nitrobenzyl sulfide
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/C18H15ClN4O2S/c1-2-11-22-17(14-5-7-15(19)8-6-14)20-21-18(22)26-12-13-3-9-16(10-4-13)23(24)25/h2-10H,1,11-12H2
InChIKey CDENDHUIAJFZPY-UHFFFAOYSA-N
NMR Offset 15.3512
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7380
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 128216; Labnumber: VGU-15215; VK_ID: VK-007384
Synonyms 4-allyl-3-(4-chlorophenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Temperature 318 °C