SpectraBase Spectrum ID |
10lkBRsrqxR |
Name |
2H-1,3-thiazine-6-carboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[(4-fluorophenyl)imino]tetrahydro-3-(2-methylpropyl)-4-oxo-, (2Z)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
499.094424908 u |
Formula |
C22H21ClF3N3O3S |
InChI |
InChI=1S/C22H21ClF3N3O3S/c1-13(2)12-29-19(30)11-18(33-21(29)28-16-5-3-14(24)4-6-16)20(31)27-15-7-9-17(10-8-15)32-22(23,25)26/h3-10,13,18H,11-12H2,1-2H3,(H,27,31)/b28-21- |
InChIKey |
DOQNULAAVYUFKO-HFTWOUSFSA-N |
Molecular Weight |
499.936 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14512 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10215825; Lab Info: PE; Lab Number: NMR/9296284 |