| SpectraBase Compound ID | 6iOAoixHnLM |
|---|---|
| InChI | InChI=1S/C8H12O2S/c1-3-5-6-7(4-2)11-8(9)10-6/h3-5H2,1-2H3 |
| InChIKey | BGUFBYXADSQUGA-UHFFFAOYSA-N |
| Mol Weight | 172.24 g/mol |
| Molecular Formula | C8H12O2S |
| Exact Mass | 172.055801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1y7CNMS7SPk |
|---|---|
| Name | 4-Ethyl-5-propyl-1,3-oxathiol-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O2S |
| InChI | InChI=1S/C8H12O2S/c1-3-5-6-7(4-2)11-8(9)10-6/h3-5H2,1-2H3 |
| InChIKey | BGUFBYXADSQUGA-UHFFFAOYSA-N |
| Molecular Weight | 172.242 g/mol |
| SMILES | C1(SC(CC)=C(O1)CCC)=O |
| SPLASH | splash10-00di-9400000000-cc3cb4fd71332e7c528e |
| Source of Spectrum | H1-50-689-7 |
| Wiley ID | 816919 |