| SpectraBase Spectrum ID |
8DjAWaS1BQE |
| Name |
benzoic acid, 4-[[[(2Z)-2-[(4-chlorophenyl)imino]tetrahydro-4-oxo-3-[(2,3,4,5,6-pentafluorophenyl)amino]-2H-1,3-thiazin-6-yl]carbonyl]amino]-, |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
598.050094696 u |
| Formula |
C25H16ClF5N4O4S |
| InChI |
InChI=1S/C25H16ClF5N4O4S/c1-39-24(38)11-2-6-13(7-3-11)32-23(37)15-10-16(36)35(25(40-15)33-14-8-4-12(26)5-9-14)34-22-20(30)18(28)17(27)19(29)21(22)31/h2-9,15,34H,10H2,1H3,(H,32,37)/b33-25- |
| InChIKey |
CZGIWVIMDYDUEV-IVQJCJPDSA-N |
| Molecular Weight |
598.932 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7304 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10222764; Lab Info: PE; Lab Number: PE-0790256 |
![benzoic acid, 4-[[[(2Z)-2-[(4-chlorophenyl)imino]tetrahydro-4-oxo-3-[(2,3,4,5,6-pentafluorophenyl)amino]-2H-1,3-thiazin-6-yl]carbonyl]amino]-,](/api/spectrum/8DjAWaS1BQE/structure.png?h=300&w=458 "benzoic acid, 4-[[[(2Z)-2-[(4-chlorophenyl)imino]tetrahydro-4-oxo-3-[(2,3,4,5,6-pentafluorophenyl)amino]-2H-1,3-thiazin-6-yl]carbonyl]amino]-,")
