| SpectraBase Spectrum ID |
B91kW1NNT01 |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[4-(ethoxycarbonyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl 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 |
409.130756641 u |
| Formula |
C18H23N3O6S |
| InChI |
InChI=1S/C18H23N3O6S/c1-4-27-18(24)21-9-7-20(8-10-21)17(28)19-14-11-12(15(22)25-2)5-6-13(14)16(23)26-3/h5-6,11H,4,7-10H2,1-3H3,(H,19,28) |
| InChIKey |
BFNOEXWZSUQMPU-UHFFFAOYSA-N |
| Molecular Weight |
409.457 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1346 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13248526 |
![1,4-benzenedicarboxylic acid, 2-[[[4-(ethoxycarbonyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester](/api/spectrum/B91kW1NNT01/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[4-(ethoxycarbonyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester")
