| SpectraBase Compound ID | CQgVCYXkxtM |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-7-5-11(9(3)12,6-8(7)2)10(13)14-4/h1-2,5-6H2,3-4H3 |
| InChIKey | XMYXGHVNVSQXDE-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BSEOAJyBvFr |
|---|---|
| Name | 1-Acetyl-3,4-dimethylene-1-cyclopentanecarboxylic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-7-5-11(9(3)12,6-8(7)2)10(13)14-4/h1-2,5-6H2,3-4H3 |
| InChIKey | XMYXGHVNVSQXDE-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | C1(CC(=C)C(C1)=C)(C(=O)OC)C(=O)C |