SpectraBase Spectrum ID |
DQwc2ZBehMR |
Name |
butanamide, 2-[(5-propyl-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 |
489.144630629 u |
Formula |
C23H22F3N5O2S |
InChI |
InChI=1S/C23H22F3N5O2S/c1-3-13-31-17-8-6-5-7-16(17)19-20(31)28-22(30-29-19)34-18(4-2)21(32)27-14-9-11-15(12-10-14)33-23(24,25)26/h5-12,18H,3-4,13H2,1-2H3,(H,27,32) |
InChIKey |
NYLZMTPDSJIYCM-UHFFFAOYSA-N |
Molecular Weight |
489.517 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5263 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10215905; Lab Info: L-23,Kulik; Lab Number: /BIUS 1607 |