![2-Butyl-3-(methylthio)benzo[b]thiophene](/api/spectrum/CqBW8X2rFAu/structure.png?h=300&w=458 "2-Butyl-3-(methylthio)benzo[b]thiophene")
| SpectraBase Compound ID | Klz8CpD1ee9 |
|---|---|
| InChI | InChI=1S/C13H16S2/c1-3-4-8-12-13(14-2)10-7-5-6-9-11(10)15-12/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | FCKMLFVMNXYBKW-UHFFFAOYSA-N |
| Mol Weight | 236.39 g/mol |
| Molecular Formula | C13H16S2 |
| Exact Mass | 236.069343 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CqBW8X2rFAu |
|---|---|
| Name | 2-Butyl-3-(methylthio)benzo[b]thiophene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16S2 |
| InChI | InChI=1S/C13H16S2/c1-3-4-8-12-13(14-2)10-7-5-6-9-11(10)15-12/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | FCKMLFVMNXYBKW-UHFFFAOYSA-N |
| Molecular Weight | 236.391 g/mol |
| SMILES | c1cc2c(c(sc2cc1)CCCC)SC |
| SPLASH | splash10-000l-0960000000-2060f80cdb9221a3fe3c |
| Source of Spectrum | A1-13-5100/SMS28-7d |
| Wiley ID | 1753743 |