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4-({[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
SpectraBase Compound ID 9LTOexX1lzM
InChI InChI=1S/C19H18N4OS/c1-3-23-18(16-6-4-5-7-17(16)24-2)21-22-19(23)25-13-15-10-8-14(12-20)9-11-15/h4-11H,3,13H2,1-2H3
InChIKey DIJVVWXKYBTYGM-UHFFFAOYSA-N
Mol Weight 350.44 g/mol
Molecular Formula C19H18N4OS
Exact Mass 350.120132 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 77i6laQJEBd
Name 4-({[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
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/C19H18N4OS/c1-3-23-18(16-6-4-5-7-17(16)24-2)21-22-19(23)25-13-15-10-8-14(12-20)9-11-15/h4-11H,3,13H2,1-2H3
InChIKey DIJVVWXKYBTYGM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11427
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: E06318; Labnumber: GRES-20457; SBI_ID: SBI-011430
Temperature 308 °C