| SpectraBase Compound ID | CKN9LePNfiu |
|---|---|
| InChI | InChI=1S/C5H8O2S/c6-5-1-3-8-4-2-7-5/h1-4H2 |
| InChIKey | JHBQZWZMGYMUFJ-UHFFFAOYSA-N |
| Mol Weight | 132.18 g/mol |
| Molecular Formula | C5H8O2S |
| Exact Mass | 132.024501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IlZkm5iKLHG |
|---|---|
| Name | 7H-1,4-Oxathiepin-7-one, tetrahydro- |
| CAS Registry Number | 5512-72-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8O2S |
| InChI | InChI=1S/C5H8O2S/c6-5-1-3-8-4-2-7-5/h1-4H2 |
| InChIKey | JHBQZWZMGYMUFJ-UHFFFAOYSA-N |
| Molecular Weight | 132.177 g/mol |
| SMILES | C1(=O)CCSCCO1 |
| SPLASH | splash10-000i-9000000000-6ef71eca13500096ec3f |
| Source of Spectrum | EP-7189-0-0 |
| Synonyms | 1,4-Oxathiepan-7-one |
| Wiley ID | 1133563 |