| SpectraBase Spectrum ID |
IOEtA9xNCvP |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[4-[[[2,5-bis(methoxycarbonyl)phenyl]amino]carbonothioyl]-1- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
588.134856218 u |
| Formula |
C26H28N4O8S2 |
| InChI |
InChI=1S/C26H28N4O8S2/c1-35-21(31)15-5-7-17(23(33)37-3)19(13-15)27-25(39)29-9-11-30(12-10-29)26(40)28-20-14-16(22(32)36-2)6-8-18(20)24(34)38-4/h5-8,13-14H,9-12H2,1-4H3,(H,27,39)(H,28,40) |
| InChIKey |
SDYMTIACOFVGMW-UHFFFAOYSA-N |
| Molecular Weight |
588.650 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1349 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13248531 |
![1,4-benzenedicarboxylic acid, 2-[[[4-[[[2,5-bis(methoxycarbonyl)phenyl]amino]carbonothioyl]-1-](/api/spectrum/IOEtA9xNCvP/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[4-[[[2,5-bis(methoxycarbonyl)phenyl]amino]carbonothioyl]-1-")
