| SpectraBase Compound ID | 8eL3oqnu09i |
|---|---|
| InChI | InChI=1S/C7H8O2S/c1-4(2)10-6-3-5(8)7(6)9/h3-4H,1-2H3 |
| InChIKey | KPMZKULVXFBNIV-UHFFFAOYSA-N |
| Mol Weight | 156.2 g/mol |
| Molecular Formula | C7H8O2S |
| Exact Mass | 156.024501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2Ffpk9RaLY |
|---|---|
| Name | 3-Isopropylthio-3-cyclobuten-1,2-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H8O2S |
| InChI | InChI=1S/C7H8O2S/c1-4(2)10-6-3-5(8)7(6)9/h3-4H,1-2H3 |
| InChIKey | KPMZKULVXFBNIV-UHFFFAOYSA-N |
| Molecular Weight | 156.199 g/mol |
| SMILES | C1(C(C(=C1)SC(C)C)=O)=O |
| SPLASH | splash10-052u-9000000000-5dd2289457c67cbdcb58 |
| Source of Spectrum | SO-0-821-0 |
| Synonyms | 3-(isopropylsulfanyl)-3-cyclobutene-1,2-dione |
| Wiley ID | 1541561 |