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phenol, 2-[1-(2-benzothiazolyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1H-1,2,4-triazol-5-yl]-
SpectraBase Compound ID 2vD1WrC35a1
InChI InChI=1S/C25H20N4O3S/c1-31-20-13-11-16(15-21(20)32-2)12-14-23-27-24(17-7-3-5-9-19(17)30)29(28-23)25-26-18-8-4-6-10-22(18)33-25/h3-15,30H,1-2H3/b14-12+
InChIKey LLYWHJBXNLIDBO-WYMLVPIESA-N
Mol Weight 456.52 g/mol
Molecular Formula C25H20N4O3S
Exact Mass 456.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 40p2KqL1OuW
Name phenol, 2-[1-(2-benzothiazolyl)-3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1H-1,2,4-triazol-5-yl]-
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/C25H20N4O3S/c1-31-20-13-11-16(15-21(20)32-2)12-14-23-27-24(17-7-3-5-9-19(17)30)29(28-23)25-26-18-8-4-6-10-22(18)33-25/h3-15,30H,1-2H3/b14-12+
InChIKey LLYWHJBXNLIDBO-WYMLVPIESA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_7487
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/18301494; Labnumber: 38