| SpectraBase Compound ID | 7Ngs4VQclbL |
|---|---|
| InChI | InChI=1S/C10H11NO2S/c1-6-5-11-10(14-6)8-3-2-7(12)4-9(8)13/h2-4,6,12-13H,5H2,1H3 |
| InChIKey | IBHJHFKWHGLRKE-UHFFFAOYSA-N |
| Mol Weight | 209.26 g/mol |
| Molecular Formula | C10H11NO2S |
| Exact Mass | 209.05105 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7hV7cQsQt5P |
|---|---|
| Name | 5-Methylthiazoline-2-resocinol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.051049770 u |
| Formula | C10H11NO2S |
| InChI | InChI=1S/C10H11NO2S/c1-6-5-11-10(14-6)8-3-2-7(12)4-9(8)13/h2-4,6,12-13H,5H2,1H3 |
| InChIKey | IBHJHFKWHGLRKE-UHFFFAOYSA-N |
| Molecular Weight | 209.263 g/mol |
| SMILES | C1(=NCC(S1)C)C1=C(C=C(C=C1)O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.871236 |