![6-((E)-{(2Z)-2-[5-(2-anilino-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazono}methyl)-2,3-dimethoxybenzoic acid](/api/spectrum/CYibk4MB3kT/structure.png?h=300&w=458 "6-((E)-{(2Z)-2-[5-(2-anilino-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazono}methyl)-2,3-dimethoxybenzoic acid")
| SpectraBase Compound ID | 2NOaV6OTHqB |
|---|---|
| InChI | InChI=1S/C21H20N4O6S/c1-30-14-9-8-12(17(20(28)29)18(14)31-2)11-22-25-21-24-19(27)15(32-21)10-16(26)23-13-6-4-3-5-7-13/h3-9,11,15H,10H2,1-2H3,(H,23,26)(H,28,29)(H,24,25,27)/b22-11+ |
| InChIKey | CQVCIBLDOOBUFU-SSDVNMTOSA-N |
| Mol Weight | 456.47 g/mol |
| Molecular Formula | C21H20N4O6S |
| Exact Mass | 456.110356 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | CYibk4MB3kT |
|---|---|
| Name | 6-((E)-{(2Z)-2-[5-(2-anilino-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazono}methyl)-2,3-dimethoxybenzoic acid |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 456.110355548 u |
| Formula | C21H20N4O6S |
| InChI | InChI=1S/C21H20N4O6S/c1-30-14-9-8-12(17(20(28)29)18(14)31-2)11-22-25-21-24-19(27)15(32-21)10-16(26)23-13-6-4-3-5-7-13/h3-9,11,15H,10H2,1-2H3,(H,23,26)(H,28,29)(H,24,25,27)/b22-11+ |
| InChIKey | CQVCIBLDOOBUFU-SSDVNMTOSA-N |
| Molecular Weight | 456.473 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_458 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12268243 |