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4-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
SpectraBase Compound ID BzIIx1tOuc8
InChI InChI=1S/C24H20N4O2S/c1-29-21-12-10-20(11-13-21)28-23(19-4-3-5-22(14-19)30-2)26-27-24(28)31-16-18-8-6-17(15-25)7-9-18/h3-14H,16H2,1-2H3
InChIKey YZMHUJLYEPBXBQ-UHFFFAOYSA-N
Mol Weight 428.51 g/mol
Molecular Formula C24H20N4O2S
Exact Mass 428.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2n061rwjBqx
Name 4-({[5-(3-methoxyphenyl)-4-(4-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/C24H20N4O2S/c1-29-21-12-10-20(11-13-21)28-23(19-4-3-5-22(14-19)30-2)26-27-24(28)31-16-18-8-6-17(15-25)7-9-18/h3-14H,16H2,1-2H3
InChIKey YZMHUJLYEPBXBQ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11125
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: E06122; Labnumber: GRES-16441; SBI_ID: SBI-011128
Temperature 306 °C