| SpectraBase Compound ID | HC11fhmFbJh |
|---|---|
| InChI | InChI=1S/C13H18O4/c1-5-7-11(4)17-13(15)9-8-12(14)16-10(3)6-2/h2,5,10-11H,1,7-9H2,3-4H3 |
| InChIKey | KUFJFZLRNQIWDK-UHFFFAOYSA-N |
| Mol Weight | 238.28 g/mol |
| Molecular Formula | C13H18O4 |
| Exact Mass | 238.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | fdRNirPXMG |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl pent-4-en-2-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/c1-5-7-11(4)17-13(15)9-8-12(14)16-10(3)6-2/h2,5,10-11H,1,7-9H2,3-4H3 |
| InChIKey | KUFJFZLRNQIWDK-UHFFFAOYSA-N |
| Molecular Weight | 238.283 g/mol |
| SMILES | C(CC(OC(C#C)C)=O)C(OC(CC=C)C)=O |