| SpectraBase Compound ID | CF0z7dbXheW |
|---|---|
| InChI | InChI=1S/C18H12N2O4S2/c21-19(22)15-11-16(20(23)24)18(26-14-9-5-2-6-10-14)12-17(15)25-13-7-3-1-4-8-13/h1-12H |
| InChIKey | ZSGRZUYNZGCHKG-UHFFFAOYSA-N |
| Mol Weight | 384.42 g/mol |
| Molecular Formula | C18H12N2O4S2 |
| Exact Mass | 384.023849 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GVfyNunLToG |
|---|---|
| Name | 1,3-bis(Phenylthio)-4,6-dinitrobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.023849218 u |
| Formula | C18H12N2O4S2 |
| InChI | InChI=1S/C18H12N2O4S2/c21-19(22)15-11-16(20(23)24)18(26-14-9-5-2-6-10-14)12-17(15)25-13-7-3-1-4-8-13/h1-12H |
| InChIKey | ZSGRZUYNZGCHKG-UHFFFAOYSA-N |
| Molecular Weight | 384.424 g/mol |
| SMILES | N(=O)(=O)C1=C(C=C(C(=C1)N(=O)=O)SC=1C=CC=CC1)SC=1C=CC=CC1 |