| SpectraBase Spectrum ID |
J7qnzjGxoUD |
| Name |
benzoic acid, 2-chloro-5-[[4-[[4-chloro-3-(methoxycarbonyl)phenyl]sulfonyl]-1-piperazinyl]sulfonyl]-, methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
550.003813352 u |
| Formula |
C20H20Cl2N2O8S2 |
| InChI |
InChI=1S/C20H20Cl2N2O8S2/c1-31-19(25)15-11-13(3-5-17(15)21)33(27,28)23-7-9-24(10-8-23)34(29,30)14-4-6-18(22)16(12-14)20(26)32-2/h3-6,11-12H,7-10H2,1-2H3 |
| InChIKey |
VOZNLXGPYQBMEI-UHFFFAOYSA-N |
| Molecular Weight |
551.412 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9024 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9254338; Lab Info: SP; Lab Number: SP-X000132 |
![benzoic acid, 2-chloro-5-[[4-[[4-chloro-3-(methoxycarbonyl)phenyl]sulfonyl]-1-piperazinyl]sulfonyl]-, methyl ester](/api/spectrum/J7qnzjGxoUD/structure.png?h=300&w=458 "benzoic acid, 2-chloro-5-[[4-[[4-chloro-3-(methoxycarbonyl)phenyl]sulfonyl]-1-piperazinyl]sulfonyl]-, methyl ester")
