SpectraBase Spectrum ID |
4nJ5wmVOXcK |
Name |
acetamide, N-[4-(acetylamino)phenyl]-2-[[5-[(3,4-dimethylphenoxy)methyl]-4-phenyl-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 |
501.183460920 u |
Formula |
C27H27N5O3S |
InChI |
InChI=1S/C27H27N5O3S/c1-18-9-14-24(15-19(18)2)35-16-25-30-31-27(32(25)23-7-5-4-6-8-23)36-17-26(34)29-22-12-10-21(11-13-22)28-20(3)33/h4-15H,16-17H2,1-3H3,(H,28,33)(H,29,34) |
InChIKey |
VHODWDNOQOLGPH-UHFFFAOYSA-N |
Molecular Weight |
501.605 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4002 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9223373; Lab Info: LP; Lab Number: LP-2190405 |
Temperature |
29.85 °C |