| SpectraBase Compound ID | AdqPDWEILMr |
|---|---|
| InChI | InChI=1S/C11H16O3/c12-9-5-4-8-11(14)7-3-1-2-6-10(11)13/h12,14H,1-3,5-7,9H2 |
| InChIKey | WXLBQMMHFNSTAU-UHFFFAOYSA-N |
| Mol Weight | 196.25 g/mol |
| Molecular Formula | C11H16O3 |
| Exact Mass | 196.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KQw1nOV57nD |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H16O3 |
| InChI | InChI=1S/C11H16O3/c12-9-5-4-8-11(14)7-3-1-2-6-10(11)13/h12,14H,1-3,5-7,9H2 |
| InChIKey | WXLBQMMHFNSTAU-UHFFFAOYSA-N |
| Molecular Weight | 196.1095 |
| SMILES | OCCC#CC1(O)CCCCCC1=O |
| SPLASH | splash10-0007-9300000000-22f3324b4e057beb14cf |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |