| SpectraBase Compound ID | BE7vTTQBEfe |
|---|---|
| InChI | InChI=1S/C16H10N2O4S/c19-15-14(10-11-5-4-8-13(9-11)18(21)22)23-16(20)17(15)12-6-2-1-3-7-12/h1-10H/b14-10+ |
| InChIKey | DBZZGDZHPICREM-GXDHUFHOSA-N |
| Mol Weight | 326.33 g/mol |
| Molecular Formula | C16H10N2O4S |
| Exact Mass | 326.036128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LRpXbBlKuQ5 |
|---|---|
| Name | 5-(3-Nitrobenzylidene)-3-phenylthiazolidine-2,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.036127980 u |
| Formula | C16H10N2O4S |
| InChI | InChI=1S/C16H10N2O4S/c19-15-14(10-11-5-4-8-13(9-11)18(21)22)23-16(20)17(15)12-6-2-1-3-7-12/h1-10H/b14-10+ |
| InChIKey | DBZZGDZHPICREM-GXDHUFHOSA-N |
| Molecular Weight | 326.326 g/mol |
| SMILES | C1(N2C(\C(=C/C3=CC(=CC=C3)N(=O)=O)SC2=O)=O)=CC=CC=C1 |