| SpectraBase Compound ID | 4YpVx7lSCWK |
|---|---|
| InChI | InChI=1S/C11H18O5/c1-3-4-7-15-10(12)5-6-11(13)16-9-8-14-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+ |
| InChIKey | GDBVZFPCLJQFDO-AATRIKPKSA-N |
| Mol Weight | 230.26 g/mol |
| Molecular Formula | C11H18O5 |
| Exact Mass | 230.115424 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 | 9stCD2F4zGK |
|---|---|
| Name | Fumaric acid, butyl 2-methoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.115423675 u |
| Formula | C11H18O5 |
| InChI | InChI=1S/C11H18O5/c1-3-4-7-15-10(12)5-6-11(13)16-9-8-14-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+ |
| InChIKey | GDBVZFPCLJQFDO-AATRIKPKSA-N |
| Molecular Weight | 230.260 g/mol |
| SMILES | CCCCOC(\C=C\C(OCCOC)=O)=O |