| SpectraBase Spectrum ID |
BAIclYX9KES |
| Name |
benzoic acid, 4-[[(2Z)-6-[[[4-(chlorodifluoromethoxy)phenyl]amino]carbonyl]tetrahydro-3-methyl-4-oxo-2H-1,3- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
511.078025951 u |
| Formula |
C22H20ClF2N3O5S |
| InChI |
InChI=1S/C22H20ClF2N3O5S/c1-3-32-20(31)13-4-6-15(7-5-13)27-21-28(2)18(29)12-17(34-21)19(30)26-14-8-10-16(11-9-14)33-22(23,24)25/h4-11,17H,3,12H2,1-2H3,(H,26,30)/b27-21- |
| InChIKey |
HBLOMMKPWDIBKZ-MEFGMAGPSA-N |
| Molecular Weight |
511.928 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14443 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10215759; Lab Info: PE; Lab Number: NMR/9296172 |
![benzoic acid, 4-[[(2Z)-6-[[[4-(chlorodifluoromethoxy)phenyl]amino]carbonyl]tetrahydro-3-methyl-4-oxo-2H-1,3-](/api/spectrum/BAIclYX9KES/structure.png?h=300&w=458 "benzoic acid, 4-[[(2Z)-6-[[[4-(chlorodifluoromethoxy)phenyl]amino]carbonyl]tetrahydro-3-methyl-4-oxo-2H-1,3-")
