| SpectraBase Compound ID | LBfOH57j5uP |
|---|---|
| InChI | InChI=1S/C8H8N2S2/c9-7(11)8(12)10-6-4-2-1-3-5-6/h1-5H,(H2,9,11)(H,10,12) |
| InChIKey | JMWQHOYFLSTEKW-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C8H8N2S2 |
| Exact Mass | 196.012891 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | E8xK2e3dKE6 |
|---|---|
| Name | Dithiophenyloxamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.012890614 u |
| Formula | C8H8N2S2 |
| InChI | InChI=1S/C8H8N2S2/c9-7(11)8(12)10-6-4-2-1-3-5-6/h1-5H,(H2,9,11)(H,10,12) |
| InChIKey | JMWQHOYFLSTEKW-UHFFFAOYSA-N |
| Molecular Weight | 196.286 g/mol |
| SMILES | NC(C(=S)NC1=CC=CC=C1)=S |
| Spectrum/Structure Validation Score (Raman) | 0.977628 |