SpectraBase Spectrum ID |
ARqeDjN6x6J |
Name |
benzoic acid, 4-[(E)-[[[[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]hydrazono]methyl]- |
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/C21H21N5O4S/c1-3-26-19(15-8-10-17(30-2)11-9-15)24-25-21(26)31-13-18(27)23-22-12-14-4-6-16(7-5-14)20(28)29/h4-12H,3,13H2,1-2H3,(H,23,27)(H,28,29)/b22-12+ |
InChIKey |
BKTQXEWIBFYQSP-WSDLNYQXSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_5713 |
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/10257941 |