| SpectraBase Compound ID | 9Il48MZ0uMi |
|---|---|
| InChI | InChI=1S/C15H16S2/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2 |
| InChIKey | JUHMSBSITSNFFN-UHFFFAOYSA-N |
| Mol Weight | 260.41 g/mol |
| Molecular Formula | C15H16S2 |
| Exact Mass | 260.069343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 34fIIJGLBwH |
|---|---|
| Name | 2-(Benzhydrylthio)ethanethiol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.069342863 u |
| Formula | C15H16S2 |
| InChI | InChI=1S/C15H16S2/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2 |
| InChIKey | JUHMSBSITSNFFN-UHFFFAOYSA-N |
| Molecular Weight | 260.413 g/mol |
| SMILES | C(C1=CC=CC=C1)(C=1C=CC=CC1)SCCS |