SpectraBase Spectrum ID |
HuNesjyl3h0 |
Name |
acetamide, 2-[[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
523.128980565 u |
Formula |
C26H20F3N5O2S |
InChI |
InChI=1S/C26H20F3N5O2S/c27-26(28,29)36-19-12-10-18(11-13-19)30-22(35)16-37-25-31-24-23(32-33-25)20-8-4-5-9-21(20)34(24)15-14-17-6-2-1-3-7-17/h1-13H,14-16H2,(H,30,35) |
InChIKey |
NRXDOUYJJSBLJI-UHFFFAOYSA-N |
Molecular Weight |
523.534 g/mol |
NMR Offset |
16.0087 |
NMR Spectrometer Frequency |
500.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4604 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9302726; Lab Info: l-23; Lab Number: l-23/0001604 |