| SpectraBase Compound ID | CxGDSa4JzXq |
|---|---|
| InChI | InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3,5H,4,6-11H2,1-2H3/b5-3+ |
| InChIKey | DYOGMCCRMUFRSF-HWKANZROSA-N |
| Mol Weight | 198.31 g/mol |
| Molecular Formula | C12H22O2 |
| Exact Mass | 198.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GxncUh8xFVn |
|---|---|
| Name | HEXANOIC ACID, 4-HEXEN-1-YL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H22O2 |
| InChI | InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3,5H,4,6-11H2,1-2H3/b5-3+ |
| InChIKey | DYOGMCCRMUFRSF-HWKANZROSA-N |
| Molecular Weight | 198.1614 |
| SMILES | CCCCCC(OCCC\C=C\C)=O |
| SPLASH | splash10-015c-9000000000-d33796f8105e0b5c75aa |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |