| SpectraBase Compound ID | GJhDqLWJVt2 |
|---|---|
| InChI | InChI=1S/C12H10N2O2S/c13-7-1-3-9-10-4-2-8(14)6-12(10)17(15,16)11(9)5-7/h1-6H,13-14H2 |
| InChIKey | FUXZRRZSHWQAAA-UHFFFAOYSA-N |
| Mol Weight | 246.28 g/mol |
| Molecular Formula | C12H10N2O2S |
| Exact Mass | 246.046299 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7BlOOlpD8YI |
|---|---|
| Name | Benzidine sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.046298742 u |
| Formula | C12H10N2O2S |
| InChI | InChI=1S/C12H10N2O2S/c13-7-1-3-9-10-4-2-8(14)6-12(10)17(15,16)11(9)5-7/h1-6H,13-14H2 |
| InChIKey | FUXZRRZSHWQAAA-UHFFFAOYSA-N |
| Molecular Weight | 246.284 g/mol |
| SMILES | C1=C(C=C2S(C3=CC(N)=CC=C3C2=C1)(=O)=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964783 |