| SpectraBase Compound ID | 1UFpQLqvx9j |
|---|---|
| InChI | InChI=1S/C15H26O4/c1-6-7-10-18-13(16)8-9-14(17)19-15(11(2)3)12(4)5/h8-9,11-12,15H,6-7,10H2,1-5H3/b9-8+ |
| InChIKey | PWWSDFHFPYOXJO-CMDGGOBGSA-N |
| Mol Weight | 270.37 g/mol |
| Molecular Formula | C15H26O4 |
| Exact Mass | 270.183109 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 | 1jCeDGS5EAT |
|---|---|
| Name | Fumaric acid, butyl 2,4-dimethylpent-3-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.183109313 u |
| Formula | C15H26O4 |
| InChI | InChI=1S/C15H26O4/c1-6-7-10-18-13(16)8-9-14(17)19-15(11(2)3)12(4)5/h8-9,11-12,15H,6-7,10H2,1-5H3/b9-8+ |
| InChIKey | PWWSDFHFPYOXJO-CMDGGOBGSA-N |
| Molecular Weight | 270.369 g/mol |
| SMILES | C(OC(C(C)C)C(C)C)(\C=C\C(OCCCC)=O)=O |