SpectraBase Spectrum ID |
76YntKKl3dI |
Name |
ethanone, 1-(4-methylphenyl)-2-[[4-(2-methylphenyl)-5-[[(4-methylphenyl)amino]methyl]-4H-1,2,4-triazol-3-yl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
442.182732646 u |
Formula |
C26H26N4OS |
InChI |
InChI=1S/C26H26N4OS/c1-18-8-12-21(13-9-18)24(31)17-32-26-29-28-25(16-27-22-14-10-19(2)11-15-22)30(26)23-7-5-4-6-20(23)3/h4-15,27H,16-17H2,1-3H3 |
InChIKey |
RYXNQVHDQHCAMD-UHFFFAOYSA-N |
Molecular Weight |
442.581 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16216 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10321054; Lab Info: DEM; Lab Number: DEM-0000170 |