| SpectraBase Compound ID | 44JNy2ba7fy |
|---|---|
| InChI | InChI=1S/C8H12N2S2/c1-3-9-7(11-5-1)8-10-4-2-6-12-8/h1-6H2 |
| InChIKey | UDJFWQITHYLDGU-UHFFFAOYSA-N |
| Mol Weight | 200.32 g/mol |
| Molecular Formula | C8H12N2S2 |
| Exact Mass | 200.044191 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CuUKYHHZU7X |
|---|---|
| Name | 2-(5,6-Dihydro-4H-1,3-thiazin-2-yl)-5,6-dihydro-4H-1,3-thiazine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.044190742 u |
| Formula | C8H12N2S2 |
| InChI | InChI=1S/C8H12N2S2/c1-3-9-7(11-5-1)8-10-4-2-6-12-8/h1-6H2 |
| InChIKey | UDJFWQITHYLDGU-UHFFFAOYSA-N |
| Molecular Weight | 200.318 g/mol |
| SMILES | C1(C2=NCCCS2)=NCCCS1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.822613 |