| SpectraBase Compound ID | 8lXwMgs4hjQ |
|---|---|
| InChI | InChI=1S/C10H12OS/c1-3-10(2)11-8-6-4-5-7-9(8)12-10/h4-7H,3H2,1-2H3 |
| InChIKey | UJGJKPLNBZYCNM-UHFFFAOYSA-N |
| Mol Weight | 180.26 g/mol |
| Molecular Formula | C10H12OS |
| Exact Mass | 180.060886 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JixUoBQew5T |
|---|---|
| Name | 2-Ethyl-2-methyl-1,3-benzoxathiole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.060886179 u |
| Formula | C10H12OS |
| InChI | InChI=1S/C10H12OS/c1-3-10(2)11-8-6-4-5-7-9(8)12-10/h4-7H,3H2,1-2H3 |
| InChIKey | UJGJKPLNBZYCNM-UHFFFAOYSA-N |
| Molecular Weight | 180.265 g/mol |
| SMILES | C1(SC2=CC=CC=C2O1)(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.847428 |