SpectraBase Spectrum ID |
5EoRgx36k1U |
Name |
4-bromo-2-((E)-{[3-(3-methyl-1H-pyrazol-5-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol |
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/C13H11BrN6OS/c1-7-4-10(17-16-7)12-18-19-13(22)20(12)15-6-8-5-9(14)2-3-11(8)21/h2-6,21H,1H3,(H,16,17)(H,19,22)/b15-6+ |
InChIKey |
JYJCNIPRLALXIY-GIDUJCDVSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_10546 |
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: E00604; Labnumber: GRES-17006; SBI_ID: SBI-010549 |
Synonyms |
4-bromo-2-({[3-(3-methyl-1H-pyrazol-5-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol |
Temperature |
318 °C |