| SpectraBase Compound ID | K1uurMsbkLN |
|---|---|
| InChI | InChI=1S/C12H18O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h3-6H,7-10H2,1-2H3/b5-3+,6-4+ |
| InChIKey | PUASBHVEXSYHGK-GGWOSOGESA-N |
| Mol Weight | 226.27 g/mol |
| Molecular Formula | C12H18O4 |
| Exact Mass | 226.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lw093EFMI6w |
|---|---|
| Name | Succinic acid, di(but-2-en-1-yl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.120509056 u |
| Formula | C12H18O4 |
| InChI | InChI=1S/C12H18O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h3-6H,7-10H2,1-2H3/b5-3+,6-4+ |
| InChIKey | PUASBHVEXSYHGK-GGWOSOGESA-N |
| Molecular Weight | 226.272 g/mol |
| SMILES | C(CC(OC\C=C\C)=O)C(OC\C=C\C)=O |