![2-[(E)-but-2-enyl]benzenethiol](/api/spectrum/1GC2DPOe6rs/structure.png?h=300&w=458 "2-[(E)-but-2-enyl]benzenethiol")
| SpectraBase Compound ID | LhSo3El6Z7B |
|---|---|
| InChI | InChI=1S/C10H12S/c1-2-3-6-9-7-4-5-8-10(9)11/h2-5,7-8,11H,6H2,1H3/b3-2+ |
| InChIKey | PQFUDCWDTHEVKR-NSCUHMNNSA-N |
| Mol Weight | 164.27 g/mol |
| Molecular Formula | C10H12S |
| Exact Mass | 164.065972 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1GC2DPOe6rs |
|---|---|
| Name | 2-[(E)-but-2-enyl]benzenethiol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H12S |
| InChI | InChI=1S/C10H12S/c1-2-3-6-9-7-4-5-8-10(9)11/h2-5,7-8,11H,6H2,1H3/b3-2+ |
| InChIKey | PQFUDCWDTHEVKR-NSCUHMNNSA-N |
| Molecular Weight | 164.266 g/mol |
| SMILES | Sc1c(C\C=C\C)cccc1 |
| SPLASH | splash10-03di-0900000000-83b6d91dc717b78248ad |
| Source of Spectrum | AJ-70-454-3 |
| Wiley ID | 773998 |