| SpectraBase Compound ID | CnP9xXWFf7t |
|---|---|
| InChI | InChI=1S/C13H18O4/c1-5-11(4)17-13(15)7-6-12(14)16-9-8-10(2)3/h1,11H,2,6-9H2,3-4H3 |
| InChIKey | GUJVOUIORAWIPO-UHFFFAOYSA-N |
| Mol Weight | 238.28 g/mol |
| Molecular Formula | C13H18O4 |
| Exact Mass | 238.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GT4HC3L271h |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl 3-methylbut-3-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.120509056 u |
| Formula | C13H18O4 |
| InChI | InChI=1S/C13H18O4/c1-5-11(4)17-13(15)7-6-12(14)16-9-8-10(2)3/h1,11H,2,6-9H2,3-4H3 |
| InChIKey | GUJVOUIORAWIPO-UHFFFAOYSA-N |
| Molecular Weight | 238.283 g/mol |
| SMILES | C(CC(OC(C#C)C)=O)C(OCCC(C)=C)=O |