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3-(3-chlorophenyl)-5-[(3,4-dichlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole
SpectraBase Compound ID 8FsG8IekeaO
InChI InChI=1S/C17H14Cl3N3S/c1-2-23-16(12-4-3-5-13(18)9-12)21-22-17(23)24-10-11-6-7-14(19)15(20)8-11/h3-9H,2,10H2,1H3
InChIKey HCSCVDUNFZEHGA-UHFFFAOYSA-N
Mol Weight 398.74 g/mol
Molecular Formula C17H14Cl3N3S
Exact Mass 396.997402 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A2eLmL9x1vd
Name 3-(3-chlorophenyl)-5-[(3,4-dichlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole
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/C17H14Cl3N3S/c1-2-23-16(12-4-3-5-13(18)9-12)21-22-17(23)24-10-11-6-7-14(19)15(20)8-11/h3-9H,2,10H2,1H3
InChIKey HCSCVDUNFZEHGA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4850
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: E08244; Labnumber: GRES-36829; SBI_ID: SBI-004852
Synonyms 5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl 3,4-dichlorobenzyl sulfide
Temperature 315 °C