| SpectraBase Compound ID | JKLluQBHgbC |
|---|---|
| InChI | InChI=1S/C11H18O2S/c1-11(2,3)14-10(13)7-8-4-5-9(12)6-8/h8H,4-7H2,1-3H3 |
| InChIKey | QEHWLSPXNXNDOA-UHFFFAOYSA-N |
| Mol Weight | 214.32 g/mol |
| Molecular Formula | C11H18O2S |
| Exact Mass | 214.102751 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EWm5AWyURNc |
|---|---|
| Name | (3-OXOCYCLOPENTYL)THIOACETIC ACID, S-tert-BUTYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H18O2S |
| InChI | InChI=1S/C11H18O2S/c1-11(2,3)14-10(13)7-8-4-5-9(12)6-8/h8H,4-7H2,1-3H3 |
| InChIKey | QEHWLSPXNXNDOA-UHFFFAOYSA-N |
| Molecular Weight | 214.1023 |
| SMILES | C1CC(=O)CC1CC(SC(C)(C)C)=O |
| SPLASH | splash10-0a4i-9100000000-5374594cf77e4225211a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |