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4-(2-methylphenyl)-2-(4-morpholinylmethyl)-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

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4-(2-methylphenyl)-2-(4-morpholinylmethyl)-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID 5OJzZGcdEds
InChI InChI=1S/C21H24N4O2S/c1-17-7-5-6-10-19(17)25-20(15-27-18-8-3-2-4-9-18)22-24(21(25)28)16-23-11-13-26-14-12-23/h2-10H,11-16H2,1H3
InChIKey KOXWFVSTVJNMOW-UHFFFAOYSA-N
Mol Weight 396.51 g/mol
Molecular Formula C21H24N4O2S
Exact Mass 396.161997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EXzCeSRWP4c
Name 4-(2-methylphenyl)-2-(4-morpholinylmethyl)-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
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/C21H24N4O2S/c1-17-7-5-6-10-19(17)25-20(15-27-18-8-3-2-4-9-18)22-24(21(25)28)16-23-11-13-26-14-12-23/h2-10H,11-16H2,1H3
InChIKey KOXWFVSTVJNMOW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5640
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: NMR/11221610; Labnumber: 0552; IOH_ID: IOH-005641