| SpectraBase Compound ID | Kexi1RH42Tk |
|---|---|
| InChI | InChI=1S/C10H14OS/c1-7-5-9(11-3)6-8(2)10(7)12-4/h5-6H,1-4H3 |
| InChIKey | BXBMJYKQQYLUDN-UHFFFAOYSA-N |
| Mol Weight | 182.28 g/mol |
| Molecular Formula | C10H14OS |
| Exact Mass | 182.076536 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GOd9ME8NXr4 |
|---|---|
| Name | Methiocarb-anisole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.076536244 u |
| Formula | C10H14OS |
| InChI | InChI=1S/C10H14OS/c1-7-5-9(11-3)6-8(2)10(7)12-4/h5-6H,1-4H3 |
| InChIKey | BXBMJYKQQYLUDN-UHFFFAOYSA-N |
| Molecular Weight | 182.281 g/mol |
| SMILES | C1=C(C=C(C(=C1C)SC)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968474 |