SpectraBase Spectrum ID |
DoixpV21jr2 |
Name |
2H-1,3-thiazine-6-carboxamide, 2-[[4-(chlorodifluoromethoxy)phenyl]imino]tetrahydro-N-(4-methoxyphenyl)-4-oxo-3-(2- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
559.114411461 u |
Formula |
C27H24ClF2N3O4S |
InChI |
InChI=1S/C27H24ClF2N3O4S/c1-36-21-11-7-19(8-12-21)31-25(35)23-17-24(34)33(16-15-18-5-3-2-4-6-18)26(38-23)32-20-9-13-22(14-10-20)37-27(28,29)30/h2-14,23H,15-17H2,1H3,(H,31,35)/b32-26- |
InChIKey |
BHIVQWMVVKHTBD-FSRJSHLRSA-N |
Molecular Weight |
560.016 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13273 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10215706; Lab Info: PE; Lab Number: NMR/9296096 |