![1H,4H-Benz[D]-1,3-thiazin-2-one](/api/spectrum/9oy4VPSD5em/structure.png?h=300&w=458 "1H,4H-Benz[D]-1,3-thiazin-2-one")
| SpectraBase Compound ID | 63OH0FsBQGy |
|---|---|
| InChI | InChI=1S/C8H7NOS/c10-8-9-7-4-2-1-3-6(7)5-11-8/h1-4H,5H2,(H,9,10) |
| InChIKey | BNIUUURYVJQILK-UHFFFAOYSA-N |
| Mol Weight | 165.21 g/mol |
| Molecular Formula | C8H7NOS |
| Exact Mass | 165.024835 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9oy4VPSD5em |
|---|---|
| Name | 1H,4H-Benz[D]-1,3-thiazin-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.024835022 u |
| Formula | C8H7NOS |
| InChI | InChI=1S/C8H7NOS/c10-8-9-7-4-2-1-3-6(7)5-11-8/h1-4H,5H2,(H,9,10) |
| InChIKey | BNIUUURYVJQILK-UHFFFAOYSA-N |
| Molecular Weight | 165.210 g/mol |
| SMILES | C1(=O)NC2=C(C=CC=C2)CS1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955178 |