| SpectraBase Compound ID | 9c5IzuB3Xs3 |
|---|---|
| InChI | InChI=1S/C15H16OS2/c1-17-13-7-3-11(4-8-13)15(16)12-5-9-14(18-2)10-6-12/h3-10,15-16H,1-2H3 |
| InChIKey | BISAOCKWWVPAPU-UHFFFAOYSA-N |
| Mol Weight | 276.41 g/mol |
| Molecular Formula | C15H16OS2 |
| Exact Mass | 276.064257 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | I7x1E47SoKT |
|---|---|
| Name | 4,4'-bis(Methykthio)benzhydrole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.064257482 u |
| Formula | C15H16OS2 |
| InChI | InChI=1S/C15H16OS2/c1-17-13-7-3-11(4-8-13)15(16)12-5-9-14(18-2)10-6-12/h3-10,15-16H,1-2H3 |
| InChIKey | BISAOCKWWVPAPU-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC(=CC1)SC)(C1=CC=C(C=C1)SC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.853893 |