![1-(2'-Methyl-[1,3]oxathiolan-2'-yl)butane-1,3-dione](/api/spectrum/7kO3qBQqzSV/structure.png?h=300&w=458 "1-(2'-Methyl-[1,3]oxathiolan-2'-yl)butane-1,3-dione")
| SpectraBase Compound ID | 8crhRJKuRGu |
|---|---|
| InChI | InChI=1S/C8H12O3S/c1-6(9)5-7(10)8(2)11-3-4-12-8/h3-5H2,1-2H3 |
| InChIKey | RASFUSQTTPGZFP-UHFFFAOYSA-N |
| Mol Weight | 188.24 g/mol |
| Molecular Formula | C8H12O3S |
| Exact Mass | 188.050715 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7kO3qBQqzSV |
|---|---|
| Name | 1-(2'-Methyl-[1,3]oxathiolan-2'-yl)butane-1,3-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O3S |
| InChI | InChI=1S/C8H12O3S/c1-6(9)5-7(10)8(2)11-3-4-12-8/h3-5H2,1-2H3 |
| InChIKey | RASFUSQTTPGZFP-UHFFFAOYSA-N |
| Molecular Weight | 188.241 g/mol |
| SMILES | C1(C(CC(=O)C)=O)(SCCO1)C |
| SPLASH | splash10-0udi-3900000000-07770c1b8932e07d366f |
| Source of Spectrum | CRT-9-973-7b |
| Wiley ID | 1709566 |