![Benzene, [(2-butoxy-3-methylbutyl)thio]-](/api/spectrum/GkdFafYKdqT/structure.png?h=300&w=458 "Benzene, [(2-butoxy-3-methylbutyl)thio]-")
| SpectraBase Compound ID | 2Azzk6oDa6Q |
|---|---|
| InChI | InChI=1S/C15H24OS/c1-4-5-11-16-15(13(2)3)12-17-14-9-7-6-8-10-14/h6-10,13,15H,4-5,11-12H2,1-3H3 |
| InChIKey | QZYOSDQUNYKBLX-UHFFFAOYSA-N |
| Mol Weight | 252.42 g/mol |
| Molecular Formula | C15H24OS |
| Exact Mass | 252.154787 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GkdFafYKdqT |
|---|---|
| Name | Benzene, [(2-butoxy-3-methylbutyl)thio]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.154786566 u |
| Formula | C15H24OS |
| InChI | InChI=1S/C15H24OS/c1-4-5-11-16-15(13(2)3)12-17-14-9-7-6-8-10-14/h6-10,13,15H,4-5,11-12H2,1-3H3 |
| InChIKey | QZYOSDQUNYKBLX-UHFFFAOYSA-N |
| Molecular Weight | 252.416 g/mol |
| SMILES | C(SC=1C=CC=CC1)C(C(C)C)OCCCC |