| SpectraBase Compound ID | FygfPEPDas2 |
|---|---|
| InChI | InChI=1S/C14H26O4/c1-5-6-7-10-17-13(15)8-9-14(16)18-12(4)11(2)3/h11-12H,5-10H2,1-4H3 |
| InChIKey | BHBOXUYWURCZTR-UHFFFAOYSA-N |
| Mol Weight | 258.36 g/mol |
| Molecular Formula | C14H26O4 |
| Exact Mass | 258.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7PXfTcdqkDf |
|---|---|
| Name | Succinic acid, 3-methylbut-2-yl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.183109313 u |
| Formula | C14H26O4 |
| InChI | InChI=1S/C14H26O4/c1-5-6-7-10-17-13(15)8-9-14(16)18-12(4)11(2)3/h11-12H,5-10H2,1-4H3 |
| InChIKey | BHBOXUYWURCZTR-UHFFFAOYSA-N |
| Molecular Weight | 258.358 g/mol |
| SMILES | C(CC(OC(C(C)C)C)=O)C(OCCCCC)=O |