| SpectraBase Compound ID | 64K96OhjROt |
|---|---|
| InChI | InChI=1S/C11H18O3/c1-10(14-11(2)13)8-6-4-3-5-7-9-12/h6,8-10H,3-5,7H2,1-2H3/b8-6- |
| InChIKey | LPAMLGFSQAUSIQ-VURMDHGXSA-N |
| Mol Weight | 198.26 g/mol |
| Molecular Formula | C11H18O3 |
| Exact Mass | 198.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7mtPM52VSvt |
|---|---|
| Name | 8-Acetoxynon-6(Z)-enal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.125594437 u |
| Formula | C11H18O3 |
| InChI | InChI=1S/C11H18O3/c1-10(14-11(2)13)8-6-4-3-5-7-9-12/h6,8-10H,3-5,7H2,1-2H3/b8-6- |
| InChIKey | LPAMLGFSQAUSIQ-VURMDHGXSA-N |
| Molecular Weight | 198.262 g/mol |
| SMILES | C(=O)(OC(\C=C/CCCCC=O)C)C |